NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
21144 2h49 7230 cing 1-original 12 MR format nomenclature mapping



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1   4.998  -8.329  -0.241
    2   2H5*    G   1          2H5*        G   1   5.634  -8.369   1.411
    3    H4*    G   1           H4*        G   1   7.277  -7.308   0.024
    4    H3*    G   1           H3*        G   1   5.766  -5.270   1.685
    5    H2*    G   1           H2*        G   1   7.358  -3.653   0.922
    6   2HO*    G   1          2HO*        G   1   9.117  -5.314   0.961
    7    H1*    G   1           H1*        G   1   7.163  -4.411  -1.690
    8    H8     G   1           H8         G   1   3.664  -5.011  -0.592
    9    H1     G   1           H1         G   1   5.052   1.268  -0.857
   10   1H2     G   1          2H2         G   1   7.277   1.536  -0.938
   11   2H2     G   1          1H2         G   1   8.356   0.142  -1.017
   12    H5T    G   1           H5T        G   1   4.287  -6.671   1.956
   13   1H5*    G   2          1H5*        G   2   9.732  -4.486   2.711
   14   2H5*    G   2          2H5*        G   2   9.862  -4.196   4.455
   15    H4*    G   2           H4*        G   2  10.677  -2.294   3.069
   16    H3*    G   2           H3*        G   2   8.281  -1.799   4.849
   17    H2*    G   2           H2*        G   2   8.462   0.523   4.219
   18   2HO*    G   2          2HO*        G   2  10.892   0.296   4.192
   19    H1*    G   2           H1*        G   2   8.818   0.038   1.566
   20    H8     G   2           H8         G   2   6.281  -2.533   2.634
   21    H1     G   2           H1         G   2   3.928   3.454   2.461
   22   1H2     G   2          2H2         G   2   5.655   4.919   2.465
   23   2H2     G   2          1H2         G   2   7.314   4.334   2.337
   24   1H5*    C   3          1H5*        C   3  11.073   1.418   5.698
   25   2H5*    C   3          2H5*        C   3  11.106   1.709   7.444
   26    H4*    C   3           H4*        C   3  10.523   3.733   6.082
   27    H3*    C   3           H3*        C   3   8.469   2.695   8.055
   28    H2*    C   3           H2*        C   3   7.215   4.683   7.548
   29   2HO*    C   3          2HO*        C   3   9.335   5.901   7.380
   30    H1*    C   3           H1*        C   3   7.642   4.584   4.845
   31   1H4     C   3          2H4         C   3   1.924   2.053   5.530
   32   2H4     C   3          1H4         C   3   2.618   0.437   5.591
   33    H5     C   3           H5         C   3   5.042   0.059   5.849
   34    H6     C   3           H6         C   3   7.195   1.148   5.871
   35   1H5*    U   4          1H5*        U   4   8.381   6.739   9.059
   36   2H5*    U   4          2H5*        U   4   8.295   6.897  10.822
   37    H4*    U   4           H4*        U   4   6.294   7.830   9.707
   38    H3*    U   4           H3*        U   4   5.813   5.360  11.393
   39    H2*    U   4           H2*        U   4   3.456   5.754  11.015
   40   2HO*    U   4          2HO*        U   4   3.779   8.130  11.111
   41    H1*    U   4           H1*        U   4   3.743   6.248   8.342
   42    H3     U   4           H3         U   4   1.660   2.188   8.775
   43    H5     U   4           H5         U   4   5.739   1.339   9.275
   44    H6     U   4           H6         U   4   6.197   3.705   9.279
   45   1H5*    A   5          1H5*        A   5   2.999   8.449  12.729
   46   2H5*    A   5          2H5*        A   5   2.729   8.274  14.469
   47    H4*    A   5           H4*        A   5   0.640   8.087  13.128
   48    H3*    A   5           H3*        A   5   1.481   5.591  14.629
   49    H2*    A   5           H2*        A   5  -0.689   4.711  14.025
   50   2HO*    A   5          2HO*        A   5  -1.855   6.716  14.265
   51    H1*    A   5           H1*        A   5  -0.466   5.481  11.402
   52    H8     A   5           H8         A   5   2.968   4.457  12.805
   53   1H6     A   5          1H6         A   5   1.214  -1.374  11.575
   54   2H6     A   5          2H6         A   5   2.586  -0.363  12.020
   55    H2     A   5           H2         A   5  -2.251   1.224  10.866
   56   1H5*    A   6          1H5*        A   6  -2.006   8.541  15.623
   57   2H5*    A   6          2H5*        A   6  -2.509   8.329  17.312
   58    H4*    A   6           H4*        A   6  -4.383   8.876  15.730
   59    H3*    A   6           H3*        A   6  -4.494   6.228  17.202
   60    H2*    A   6           H2*        A   6  -6.713   6.011  16.281
   61   2HO*    A   6          2HO*        A   6  -7.000   8.427  16.568
   62    H1*    A   6           H1*        A   6  -6.016   6.851  13.761
   63    H8     A   6           H8         A   6  -3.157   4.663  14.857
   64   1H6     A   6          1H6         A   6  -6.878  -0.108  13.333
   65   2H6     A   6          2H6         A   6  -5.222   0.291  13.777
   66    H2     A   6           H2         A   6  -9.334   3.516  13.464
   67   1H5*    G   7          1H5*        G   7  -8.308   7.145  17.992
   68   2H5*    G   7          2H5*        G   7  -8.670   6.793  19.693
   69    H4*    G   7           H4*        G   7  -9.961   5.355  18.158
   70    H3*    G   7           H3*        G   7  -7.895   3.927  19.849
   71    H2*    G   7           H2*        G   7  -8.789   1.860  18.941
   72   2HO*    G   7          2HO*        G   7 -11.012   2.909  18.891
   73    H1*    G   7           H1*        G   7  -8.775   2.714  16.368
   74    H8     G   7           H8         G   7  -5.732   4.384  17.863
   75    H1     G   7           H1         G   7  -4.945  -1.934  16.968
   76   1H2     G   7          2H2         G   7  -6.917  -2.886  16.579
   77   2H2     G   7          1H2         G   7  -8.384  -1.916  16.423
   78   1H5*    A   8          1H5*        A   8 -11.467   1.643  20.219
   79   2H5*    A   8          2H5*        A   8 -11.705   1.125  21.893
   80    H4*    A   8           H4*        A   8 -11.616  -0.753  20.224
   81    H3*    A   8           H3*        A   8  -9.565  -0.650  22.445
   82    H2*    A   8           H2*        A   8  -8.838  -2.837  21.693
   83   2HO*    A   8          2HO*        A   8 -11.191  -3.337  21.172
   84    H1*    A   8           H1*        A   8  -8.855  -2.196  19.032
   85    H8     A   8           H8         A   8  -7.543   0.960  20.564
   86   1H6     A   8          1H6         A   8  -2.022  -1.930  20.348
   87   2H6     A   8          2H6         A   8  -2.820  -0.367  20.465
   88    H2     A   8           H2         A   8  -5.187  -4.996  19.973
   89   1H5*    C   9          1H5*        C   9 -11.222  -4.600  22.732
   90   2H5*    C   9          2H5*        C   9 -11.574  -4.954  24.436
   91    H4*    C   9           H4*        C   9 -10.019  -6.622  23.511
   92    H3*    C   9           H3*        C   9  -8.774  -4.705  25.517
   93    H2*    C   9           H2*        C   9  -6.816  -6.074  25.437
   94   2HO*    C   9          2HO*        C   9  -8.352  -8.034  25.175
   95    H1*    C   9           H1*        C   9  -6.908  -6.387  22.684
   96   1H4     C   9          2H4         C   9  -2.785  -1.709  23.528
   97   2H4     C   9          1H4         C   9  -4.052  -0.492  23.702
   98    H5     C   9           H5         C   9  -6.446  -1.143  23.829
   99    H6     C   9           H6         C   9  -7.968  -3.007  23.697
  100    H3T    C   9           H3T        C   9  -9.284  -6.298  26.950
  101   1H5*    G  10          1H5*        G  10   6.794  -5.606  21.834
  102   2H5*    G  10          2H5*        G  10   6.854  -6.910  20.640
  103    H4*    G  10           H4*        G  10   5.756  -7.918  22.417
  104    H3*    G  10           H3*        G  10   3.575  -6.807  20.618
  105    H2*    G  10           H2*        G  10   1.989  -7.854  21.987
  106   2HO*    G  10          2HO*        G  10   3.485  -9.735  22.318
  107    H1*    G  10           H1*        G  10   3.124  -7.023  24.322
  108    H8     G  10           H8         G  10   3.924  -3.943  22.634
  109    H1     G  10           H1         G  10  -2.443  -4.541  23.337
  110   1H2     G  10          2H2         G  10  -2.966  -6.709  23.524
  111   2H2     G  10          1H2         G  10  -1.712  -7.944  23.644
  112    H5T    G  10           H5T        G  10   5.209  -5.988  19.503
  113   1H5*    U  11          1H5*        U  11   2.550 -10.616  19.874
  114   2H5*    U  11          2H5*        U  11   2.285 -10.874  18.142
  115    H4*    U  11           H4*        U  11   0.199 -11.064  19.421
  116    H3*    U  11           H3*        U  11   0.358  -8.648  17.603
  117    H2*    U  11           H2*        U  11  -1.956  -8.265  18.176
  118   2HO*    U  11          2HO*        U  11  -2.372 -10.636  18.207
  119    H1*    U  11           H1*        U  11  -1.637  -8.689  20.831
  120    H3     U  11           H3         U  11  -2.391  -4.237  20.052
  121    H5     U  11           H5         U  11   1.767  -4.733  19.667
  122    H6     U  11           H6         U  11   1.447  -7.126  19.805
  123   1H5*    C  12          1H5*        C  12  -3.381 -10.707  16.626
  124   2H5*    C  12          2H5*        C  12  -3.680 -10.559  14.887
  125    H4*    C  12           H4*        C  12  -5.498  -9.625  16.373
  126    H3*    C  12           H3*        C  12  -4.115  -7.799  14.394
  127    H2*    C  12           H2*        C  12  -5.705  -6.110  15.037
  128   2HO*    C  12          2HO*        C  12  -7.387  -7.899  15.217
  129    H1*    C  12           H1*        C  12  -5.622  -6.672  17.733
  130   1H4     C  12          2H4         C  12  -2.001  -1.630  17.097
  131   2H4     C  12          1H4         C  12  -0.529  -2.596  16.950
  132    H5     C  12           H5         C  12  -0.671  -5.081  16.629
  133    H6     C  12           H6         C  12  -2.200  -6.954  16.606
  134   1H5*    G  13          1H5*        G  13  -7.966  -6.481  13.697
  135   2H5*    G  13          2H5*        G  13  -8.204  -6.430  11.943
  136    H4*    G  13           H4*        G  13  -8.438  -4.198  12.882
  137    H3*    G  13           H3*        G  13  -5.951  -4.605  11.210
  138    H2*    G  13           H2*        G  13  -5.558  -2.257  11.387
  139   2HO*    G  13          2HO*        G  13  -7.833  -1.668  11.166
  140    H1*    G  13           H1*        G  13  -6.106  -2.128  14.084
  141    H8     G  13           H8         G  13  -4.376  -5.396  13.045
  142    H1     G  13           H1         G  13  -0.303  -0.548  14.107
  143   1H2     G  13          1H2         G  13  -1.425   1.326  14.516
  144   2H2     G  13          2H2         G  13  -3.164   1.398  14.450
  145   1H5*    A  14          1H5*        A  14  -7.789  -1.158   7.261
  146   2H5*    A  14          2H5*        A  14  -6.638  -0.642   8.517
  147    H4*    A  14           H4*        A  14  -9.611   0.069   8.422
  148    H3*    A  14           H3*        A  14  -7.108   1.566   7.618
  149    H2*    A  14           H2*        A  14  -8.088   3.601   8.436
  150   2HO*    A  14          2HO*        A  14 -10.276   2.756   7.683
  151    H1*    A  14           H1*        A  14  -8.911   2.552  10.805
  152    H8     A  14           H8         A  14  -5.823   0.546  10.399
  153   1H6     A  14          1H6         A  14  -2.688   5.721  11.857
  154   2H6     A  14          2H6         A  14  -2.518   3.989  11.568
  155    H2     A  14           H2         A  14  -6.822   6.872  10.874
  156   1H5*    A  15          1H5*        A  15  -9.514   4.545   6.366
  157   2H5*    A  15          2H5*        A  15  -9.089   4.950   4.692
  158    H4*    A  15           H4*        A  15  -8.801   6.880   6.175
  159    H3*    A  15           H3*        A  15  -6.252   5.734   5.012
  160    H2*    A  15           H2*        A  15  -5.102   7.614   6.006
  161   2HO*    A  15          2HO*        A  15  -7.088   8.987   5.546
  162    H1*    A  15           H1*        A  15  -6.314   7.398   8.429
  163    H8     A  15           H8         A  15  -6.010   3.832   7.405
  164   1H6     A  15          1H6         A  15   0.061   4.300   8.673
  165   2H6     A  15          2H6         A  15  -1.231   3.160   8.256
  166    H2     A  15           H2         A  15  -1.662   8.324   8.886
  167   1H5*    G  16          1H5*        G  16  -5.703   9.828   4.332
  168   2H5*    G  16          2H5*        G  16  -5.108  10.075   2.683
  169    H4*    G  16           H4*        G  16  -3.582  10.971   4.438
  170    H3*    G  16           H3*        G  16  -2.559   8.754   2.653
  171    H2*    G  16           H2*        G  16  -0.396   9.103   3.679
  172   2HO*    G  16          2HO*        G  16  -0.922  11.501   3.789
  173    H1*    G  16           H1*        G  16  -1.356   9.235   6.234
  174    H8     G  16           H8         G  16  -3.508   6.575   4.697
  175    H1     G  16           H1         G  16   2.528   4.588   5.717
  176   1H2     G  16          2H2         G  16   3.878   6.371   5.897
  177   2H2     G  16          1H2         G  16   3.200   7.996   6.009
  178   1H5*    C  17          1H5*        C  17   0.455  11.778   2.436
  179   2H5*    C  17          2H5*        C  17   0.962  11.980   0.750
  180    H4*    C  17           H4*        C  17   2.849  11.398   2.263
  181    H3*    C  17           H3*        C  17   2.108   9.394   0.117
  182    H2*    C  17           H2*        C  17   4.099   8.184   0.749
  183   2HO*    C  17          2HO*        C  17   5.185  10.353   1.154
  184    H1*    C  17           H1*        C  17   3.689   8.474   3.454
  185   1H4     C  17          2H4         C  17   1.384   2.744   2.269
  186   2H4     C  17          1H4         C  17  -0.231   3.395   2.003
  187    H5     C  17           H5         C  17  -0.623   5.834   1.761
  188    H6     C  17           H6         C  17   0.415   8.004   1.946
  189   1H5*    C  18          1H5*        C  18   6.420  10.045  -0.335
  190   2H5*    C  18          2H5*        C  18   6.709  10.307  -2.063
  191    H4*    C  18           H4*        C  18   8.132   8.493  -1.246
  192    H3*    C  18           H3*        C  18   5.852   7.544  -3.032
  193    H2*    C  18           H2*        C  18   6.929   5.418  -3.030
  194   2HO*    C  18          2HO*        C  18   9.091   6.544  -3.104
  195    H1*    C  18           H1*        C  18   7.541   5.520  -0.315
  196   1H4     C  18          2H4         C  18   2.344   1.977  -0.684
  197   2H4     C  18          1H4         C  18   1.280   3.382  -0.725
  198    H5     C  18           H5         C  18   2.199   5.685  -0.969
  199    H6     C  18           H6         C  18   4.244   6.972  -1.062
  200    H3T    C  18           H3T        C  18   7.297   8.969  -4.043
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1   5.788  -8.456  -0.059
    2   2H5*    G   1          2H5*        G   1   6.415  -8.408   1.596
    3    H4*    G   1           H4*        G   1   7.971  -7.240   0.197
    4    H3*    G   1           H3*        G   1   6.279  -5.301   1.801
    5    H2*    G   1           H2*        G   1   7.738  -3.574   1.013
    6   2HO*    G   1          2HO*        G   1   9.631  -5.072   1.105
    7    H1*    G   1           H1*        G   1   7.632  -4.405  -1.582
    8    H8     G   1           H8         G   1   4.186  -5.260  -0.467
    9    H1     G   1           H1         G   1   5.056   1.099  -0.940
   10   1H2     G   1          2H2         G   1   7.251   1.546  -1.034
   11   2H2     G   1          1H2         G   1   8.441   0.243  -1.069
   12    H5T    G   1           H5T        G   1   4.925  -6.819   2.098
   13   1H5*    G   2          1H5*        G   2  10.180  -4.197   2.854
   14   2H5*    G   2          2H5*        G   2  10.259  -3.835   4.587
   15    H4*    G   2           H4*        G   2  10.952  -1.930   3.137
   16    H3*    G   2           H3*        G   2   8.502  -1.545   4.870
   17    H2*    G   2           H2*        G   2   8.530   0.761   4.154
   18   2HO*    G   2          2HO*        G   2  10.966   0.713   4.160
   19    H1*    G   2           H1*        G   2   8.942   0.197   1.525
   20    H8     G   2           H8         G   2   6.590  -2.508   2.696
   21    H1     G   2           H1         G   2   3.810   3.280   2.289
   22   1H2     G   2          2H2         G   2   5.431   4.866   2.212
   23   2H2     G   2          1H2         G   2   7.127   4.393   2.103
   24   1H5*    C   3          1H5*        C   3  11.070   1.882   5.641
   25   2H5*    C   3          2H5*        C   3  11.043   2.252   7.372
   26    H4*    C   3           H4*        C   3  10.362   4.169   5.904
   27    H3*    C   3           H3*        C   3   8.327   3.096   7.877
   28    H2*    C   3           H2*        C   3   6.976   4.987   7.249
   29   2HO*    C   3          2HO*        C   3   9.001   6.332   7.065
   30    H1*    C   3           H1*        C   3   7.452   4.759   4.563
   31   1H4     C   3          2H4         C   3   1.901   1.901   5.430
   32   2H4     C   3          1H4         C   3   2.699   0.337   5.561
   33    H5     C   3           H5         C   3   5.146   0.133   5.821
   34    H6     C   3           H6         C   3   7.221   1.361   5.772
   35   1H5*    U   4          1H5*        U   4   7.788   7.074   8.709
   36   2H5*    U   4          2H5*        U   4   7.678   7.295  10.465
   37    H4*    U   4           H4*        U   4   5.569   7.919   9.339
   38    H3*    U   4           H3*        U   4   5.363   5.349  10.917
   39    H2*    U   4           H2*        U   4   2.987   5.550  10.677
   40   2HO*    U   4          2HO*        U   4   2.826   7.902  10.654
   41    H1*    U   4           H1*        U   4   3.256   5.953   7.995
   42    H3     U   4           H3         U   4   1.720   1.685   8.767
   43    H5     U   4           H5         U   4   5.891   1.409   9.137
   44    H6     U   4           H6         U   4   6.031   3.809   8.974
   45   1H5*    A   5          1H5*        A   5   2.535   8.100  14.370
   46   2H5*    A   5          2H5*        A   5   3.064   6.626  13.536
   47    H4*    A   5           H4*        A   5   0.455   8.108  12.973
   48    H3*    A   5           H3*        A   5   1.117   5.605  14.553
   49    H2*    A   5           H2*        A   5  -1.025   4.727  13.922
   50   2HO*    A   5          2HO*        A   5  -2.188   6.749  14.067
   51    H1*    A   5           H1*        A   5  -0.739   5.398  11.281
   52    H8     A   5           H8         A   5   2.677   4.510  12.747
   53   1H6     A   5          1H6         A   5   1.192  -1.379  11.429
   54   2H6     A   5          2H6         A   5   2.523  -0.316  11.873
   55    H2     A   5           H2         A   5  -2.404   1.060  10.829
   56   1H5*    A   6          1H5*        A   6  -2.389   8.572  15.382
   57   2H5*    A   6          2H5*        A   6  -2.893   8.421  17.077
   58    H4*    A   6           H4*        A   6  -4.776   8.865  15.476
   59    H3*    A   6           H3*        A   6  -4.821   6.282  17.060
   60    H2*    A   6           H2*        A   6  -7.028   5.951  16.145
   61   2HO*    A   6          2HO*        A   6  -7.391   8.368  16.318
   62    H1*    A   6           H1*        A   6  -6.353   6.683  13.590
   63    H8     A   6           H8         A   6  -3.401   4.685  14.777
   64   1H6     A   6          1H6         A   6  -6.895  -0.321  13.507
   65   2H6     A   6          2H6         A   6  -5.256   0.182  13.911
   66    H2     A   6           H2         A   6  -9.527   3.183  13.505
   67   1H5*    G   7          1H5*        G   7  -8.638   7.064  17.836
   68   2H5*    G   7          2H5*        G   7  -8.975   6.783  19.555
   69    H4*    G   7           H4*        G   7 -10.197   5.201  18.110
   70    H3*    G   7           H3*        G   7  -8.043   3.970  19.846
   71    H2*    G   7           H2*        G   7  -8.831   1.817  19.048
   72   2HO*    G   7          2HO*        G   7 -11.108   2.737  18.975
   73    H1*    G   7           H1*        G   7  -8.888   2.544  16.437
   74    H8     G   7           H8         G   7  -5.926   4.436  17.836
   75    H1     G   7           H1         G   7  -4.807  -1.859  17.165
   76   1H2     G   7          2H2         G   7  -6.729  -2.929  16.834
   77   2H2     G   7          1H2         G   7  -8.248  -2.045  16.656
   78   1H5*    A   8          1H5*        A   8 -11.501   1.528  20.374
   79   2H5*    A   8          2H5*        A   8 -11.680   1.058  22.069
   80    H4*    A   8           H4*        A   8 -11.518  -0.869  20.458
   81    H3*    A   8           H3*        A   8  -9.443  -0.589  22.641
   82    H2*    A   8           H2*        A   8  -8.611  -2.755  21.941
   83   2HO*    A   8          2HO*        A   8 -10.940  -3.396  21.469
   84    H1*    A   8           H1*        A   8  -8.692  -2.193  19.264
   85    H8     A   8           H8         A   8  -7.541   1.073  20.694
   86   1H6     A   8          1H6         A   8  -1.874  -1.521  20.544
   87   2H6     A   8          2H6         A   8  -2.754  -0.001  20.622
   88    H2     A   8           H2         A   8  -4.869  -4.762  20.265
   89   1H5*    C   9          1H5*        C   9 -10.903  -4.602  23.059
   90   2H5*    C   9          2H5*        C   9 -11.170  -4.960  24.777
   91    H4*    C   9           H4*        C   9  -9.546  -6.535  23.755
   92    H3*    C   9           H3*        C   9  -8.413  -4.611  25.819
   93    H2*    C   9           H2*        C   9  -6.359  -5.796  25.666
   94   2HO*    C   9          2HO*        C   9  -6.217  -7.754  24.461
   95    H1*    C   9           H1*        C   9  -6.475  -6.068  22.894
   96   1H4     C   9          2H4         C   9  -2.594  -1.215  23.736
   97   2H4     C   9          1H4         C   9  -3.924  -0.064  23.889
   98    H5     C   9           H5         C   9  -6.279  -0.833  24.039
   99    H6     C   9           H6         C   9  -7.705  -2.774  23.937
  100    H3T    C   9           H3T        C   9  -8.765  -7.382  26.054
  101   1H5*    G  10          1H5*        G  10   7.159  -4.644  22.077
  102   2H5*    G  10          2H5*        G  10   7.274  -5.999  20.945
  103    H4*    G  10           H4*        G  10   6.257  -6.979  22.784
  104    H3*    G  10           H3*        G  10   3.995  -6.074  20.971
  105    H2*    G  10           H2*        G  10   2.486  -7.137  22.413
  106   2HO*    G  10          2HO*        G  10   4.090  -8.915  22.811
  107    H1*    G  10           H1*        G  10   3.602  -6.131  24.687
  108    H8     G  10           H8         G  10   4.225  -3.099  22.854
  109    H1     G  10           H1         G  10  -2.097  -3.991  23.632
  110   1H2     G  10          2H2         G  10  -2.507  -6.173  23.906
  111   2H2     G  10          1H2         G  10  -1.189  -7.334  24.081
  112    H5T    G  10           H5T        G  10   5.565  -5.223  19.793
  113   1H5*    U  11          1H5*        U  11   3.159  -9.959  20.434
  114   2H5*    U  11          2H5*        U  11   2.898 -10.321  18.719
  115    H4*    U  11           H4*        U  11   0.833 -10.560  20.023
  116    H3*    U  11           H3*        U  11   0.850  -8.233  18.087
  117    H2*    U  11           H2*        U  11  -1.477  -7.946  18.660
  118   2HO*    U  11          2HO*        U  11  -1.763 -10.333  18.810
  119    H1*    U  11           H1*        U  11  -1.123  -8.222  21.330
  120    H3     U  11           H3         U  11  -2.122  -3.860  20.341
  121    H5     U  11           H5         U  11   2.054  -4.148  19.953
  122    H6     U  11           H6         U  11   1.866  -6.546  20.208
  123   1H5*    C  12          1H5*        C  12  -2.774 -10.540  17.236
  124   2H5*    C  12          2H5*        C  12  -3.087 -10.494  15.494
  125    H4*    C  12           H4*        C  12  -4.948  -9.588  16.942
  126    H3*    C  12           H3*        C  12  -3.674  -7.789  14.868
  127    H2*    C  12           H2*        C  12  -5.352  -6.161  15.437
  128   2HO*    C  12          2HO*        C  12  -6.935  -8.023  15.717
  129    H1*    C  12           H1*        C  12  -5.225  -6.579  18.156
  130   1H4     C  12          2H4         C  12  -1.881  -1.392  17.261
  131   2H4     C  12          1H4         C  12  -0.359  -2.285  17.156
  132    H5     C  12           H5         C  12  -0.370  -4.786  16.954
  133    H6     C  12           H6         C  12  -1.796  -6.737  17.026
  134   1H5*    G  13          1H5*        G  13  -7.598  -6.720  14.136
  135   2H5*    G  13          2H5*        G  13  -7.847  -6.765  12.384
  136    H4*    G  13           H4*        G  13  -8.202  -4.508  13.224
  137    H3*    G  13           H3*        G  13  -5.710  -4.849  11.545
  138    H2*    G  13           H2*        G  13  -5.452  -2.477  11.612
  139   2HO*    G  13          2HO*        G  13  -7.760  -2.029  11.393
  140    H1*    G  13           H1*        G  13  -5.979  -2.256  14.305
  141    H8     G  13           H8         G  13  -4.080  -5.470  13.401
  142    H1     G  13           H1         G  13  -0.270  -0.369  14.223
  143   1H2     G  13          1H2         G  13  -1.490   1.463  14.538
  144   2H2     G  13          2H2         G  13  -3.232   1.437  14.475
  145   1H5*    A  14          1H5*        A  14  -7.820  -1.678   7.482
  146   2H5*    A  14          2H5*        A  14  -6.678  -1.046   8.693
  147    H4*    A  14           H4*        A  14  -9.690  -0.519   8.636
  148    H3*    A  14           H3*        A  14  -7.298   1.087   7.721
  149    H2*    A  14           H2*        A  14  -8.360   3.095   8.499
  150   2HO*    A  14          2HO*        A  14 -10.518   2.112   7.829
  151    H1*    A  14           H1*        A  14  -9.076   2.089  10.921
  152    H8     A  14           H8         A  14  -5.909   0.220  10.550
  153   1H6     A  14          1H6         A  14  -2.988   5.596  11.693
  154   2H6     A  14          2H6         A  14  -2.747   3.859  11.493
  155    H2     A  14           H2         A  14  -7.185   6.510  10.724
  156   1H5*    A  15          1H5*        A  15  -9.795   3.928   6.447
  157   2H5*    A  15          2H5*        A  15  -9.440   4.274   4.744
  158    H4*    A  15           H4*        A  15  -9.128   6.269   6.123
  159    H3*    A  15           H3*        A  15  -6.598   5.100   4.944
  160    H2*    A  15           H2*        A  15  -5.439   7.031   5.823
  161   2HO*    A  15          2HO*        A  15  -7.447   8.368   5.361
  162    H1*    A  15           H1*        A  15  -6.573   6.909   8.286
  163    H8     A  15           H8         A  15  -6.304   3.307   7.418
  164   1H6     A  15          1H6         A  15  -0.195   3.796   8.458
  165   2H6     A  15          2H6         A  15  -1.502   2.652   8.115
  166    H2     A  15           H2         A  15  -1.898   7.839   8.567
  167   1H5*    G  16          1H5*        G  16  -6.204   9.200   4.055
  168   2H5*    G  16          2H5*        G  16  -5.645   9.388   2.387
  169    H4*    G  16           H4*        G  16  -4.136  10.434   4.077
  170    H3*    G  16           H3*        G  16  -3.040   8.187   2.374
  171    H2*    G  16           H2*        G  16  -0.877   8.699   3.335
  172   2HO*    G  16          2HO*        G  16  -1.519  11.067   3.343
  173    H1*    G  16           H1*        G  16  -1.802   8.901   5.901
  174    H8     G  16           H8         G  16  -3.819   6.053   4.519
  175    H1     G  16           H1         G  16   2.343   4.473   5.509
  176   1H2     G  16          2H2         G  16   3.584   6.347   5.602
  177   2H2     G  16          1H2         G  16   2.806   7.927   5.669
  178   1H5*    C  17          1H5*        C  17  -0.205  11.374   1.949
  179   2H5*    C  17          2H5*        C  17   0.249  11.525   0.243
  180    H4*    C  17           H4*        C  17   2.206  11.147   1.730
  181    H3*    C  17           H3*        C  17   1.550   8.989  -0.292
  182    H2*    C  17           H2*        C  17   3.635   7.954   0.342
  183   2HO*    C  17          2HO*        C  17   4.598  10.188   0.592
  184    H1*    C  17           H1*        C  17   3.273   8.354   3.040
  185   1H4     C  17          2H4         C  17   1.355   2.420   2.161
  186   2H4     C  17          1H4         C  17  -0.306   2.947   1.909
  187    H5     C  17           H5         C  17  -0.878   5.338   1.586
  188    H6     C  17           H6         C  17   0.005   7.583   1.652
  189   1H5*    C  18          1H5*        C  18   5.796  10.038  -0.930
  190   2H5*    C  18          2H5*        C  18   6.040  10.144  -2.684
  191    H4*    C  18           H4*        C  18   7.621   8.548  -1.628
  192    H3*    C  18           H3*        C  18   5.535   7.363  -3.498
  193    H2*    C  18           H2*        C  18   6.648   5.280  -3.272
  194   2HO*    C  18          2HO*        C  18   8.699   5.124  -2.264
  195    H1*    C  18           H1*        C  18   7.204   5.606  -0.539
  196   1H4     C  18          2H4         C  18   2.353   1.604  -0.774
  197   2H4     C  18          1H4         C  18   1.179   2.914  -0.882
  198    H5     C  18           H5         C  18   1.898   5.265  -1.255
  199    H6     C  18           H6         C  18   3.825   6.717  -1.422
  200    H3T    C  18           H3T        C  18   8.292   7.592  -3.929
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1   5.856  -8.564   0.952
    2   2H5*    G   1          2H5*        G   1   6.494  -8.402   2.596
    3    H4*    G   1           H4*        G   1   8.037  -7.326   1.110
    4    H3*    G   1           H3*        G   1   6.349  -5.288   2.590
    5    H2*    G   1           H2*        G   1   7.797  -3.615   1.678
    6   2HO*    G   1          2HO*        G   1   9.697  -5.092   1.863
    7    H1*    G   1           H1*        G   1   7.682  -4.624  -0.854
    8    H8     G   1           H8         G   1   4.244  -5.398   0.350
    9    H1     G   1           H1         G   1   5.101   0.907  -0.615
   10   1H2     G   1          2H2         G   1   7.294   1.347  -0.764
   11   2H2     G   1          1H2         G   1   8.486   0.046  -0.707
   12    H5T    G   1           H5T        G   1   5.002  -6.788   3.001
   13   1H5*    G   2          1H5*        G   2  10.263  -4.119   3.559
   14   2H5*    G   2          2H5*        G   2  10.341  -3.628   5.260
   15    H4*    G   2           H4*        G   2  11.033  -1.838   3.669
   16    H3*    G   2           H3*        G   2   8.583  -1.320   5.368
   17    H2*    G   2           H2*        G   2   8.616   0.925   4.475
   18   2HO*    G   2          2HO*        G   2  11.049   0.878   4.485
   19    H1*    G   2           H1*        G   2   9.021   0.156   1.897
   20    H8     G   2           H8         G   2   6.667  -2.445   3.293
   21    H1     G   2           H1         G   2   3.896   3.299   2.456
   22   1H2     G   2          2H2         G   2   5.522   4.869   2.228
   23   2H2     G   2          1H2         G   2   7.215   4.382   2.132
   24   1H5*    C   3          1H5*        C   3  11.172   2.142   5.890
   25   2H5*    C   3          2H5*        C   3  11.129   2.657   7.584
   26    H4*    C   3           H4*        C   3  10.469   4.441   5.941
   27    H3*    C   3           H3*        C   3   8.412   3.561   7.987
   28    H2*    C   3           H2*        C   3   7.083   5.404   7.175
   29   2HO*    C   3          2HO*        C   3   9.119   6.706   6.871
   30    H1*    C   3           H1*        C   3   7.554   4.902   4.532
   31   1H4     C   3          2H4         C   3   2.004   2.159   5.712
   32   2H4     C   3          1H4         C   3   2.800   0.608   5.951
   33    H5     C   3           H5         C   3   5.249   0.421   6.227
   34    H6     C   3           H6         C   3   7.325   1.634   6.051
   35   1H5*    U   4          1H5*        U   4   7.742   7.510   8.413
   36   2H5*    U   4          2H5*        U   4   7.629   7.923  10.133
   37    H4*    U   4           H4*        U   4   5.490   8.319   8.956
   38    H3*    U   4           H3*        U   4   5.418   5.959  10.844
   39    H2*    U   4           H2*        U   4   3.032   6.013  10.621
   40   2HO*    U   4          2HO*        U   4   2.757   8.336  10.308
   41    H1*    U   4           H1*        U   4   3.251   6.096   7.905
   42    H3     U   4           H3         U   4   1.958   1.878   9.208
   43    H5     U   4           H5         U   4   6.150   1.847   9.417
   44    H6     U   4           H6         U   4   6.153   4.222   9.002
   45   1H5*    A   5          1H5*        A   5   2.538   9.008  13.954
   46   2H5*    A   5          2H5*        A   5   3.082   7.459  13.284
   47    H4*    A   5           H4*        A   5   0.419   8.800  12.628
   48    H3*    A   5           H3*        A   5   1.211   6.556  14.508
   49    H2*    A   5           H2*        A   5  -0.913   5.533  14.096
   50   2HO*    A   5          2HO*        A   5  -2.136   7.525  14.031
   51    H1*    A   5           H1*        A   5  -0.781   5.871  11.381
   52    H8     A   5           H8         A   5   2.714   5.236  12.855
   53   1H6     A   5          1H6         A   5   1.414  -0.777  11.930
   54   2H6     A   5          2H6         A   5   2.709   0.351  12.318
   55    H2     A   5           H2         A   5  -2.250   1.502  11.170
   56   1H5*    A   6          1H5*        A   6  -3.274   7.606  17.692
   57   2H5*    A   6          2H5*        A   6  -3.120   6.143  16.691
   58    H4*    A   6           H4*        A   6  -4.718   8.641  15.945
   59    H3*    A   6           H3*        A   6  -5.501   5.961  17.101
   60    H2*    A   6           H2*        A   6  -7.535   6.035  15.838
   61   2HO*    A   6          2HO*        A   6  -7.568   8.470  16.140
   62    H1*    A   6           H1*        A   6  -6.316   6.688  13.505
   63    H8     A   6           H8         A   6  -3.532   4.677  14.711
   64   1H6     A   6          1H6         A   6  -6.959  -0.356  13.420
   65   2H6     A   6          2H6         A   6  -5.335   0.167  13.851
   66    H2     A   6           H2         A   6  -9.649   3.110  13.471
   67   1H5*    G   7          1H5*        G   7  -8.814   6.724  17.977
   68   2H5*    G   7          2H5*        G   7  -9.242   6.335  19.655
   69    H4*    G   7           H4*        G   7 -10.252   4.769  18.016
   70    H3*    G   7           H3*        G   7  -8.173   3.552  19.856
   71    H2*    G   7           H2*        G   7  -8.839   1.417  18.904
   72   2HO*    G   7          2HO*        G   7 -11.134   2.259  18.725
   73    H1*    G   7           H1*        G   7  -8.764   2.308  16.332
   74    H8     G   7           H8         G   7  -5.920   4.124  18.021
   75    H1     G   7           H1         G   7  -4.701  -2.116  17.056
   76   1H2     G   7          2H2         G   7  -6.605  -3.185  16.624
   77   2H2     G   7          1H2         G   7  -8.123  -2.302  16.432
   78   1H5*    A   8          1H5*        A   8 -11.581   0.998  20.038
   79   2H5*    A   8          2H5*        A   8 -11.868   0.456  21.697
   80    H4*    A   8           H4*        A   8 -11.563  -1.403  20.034
   81    H3*    A   8           H3*        A   8  -9.632  -1.167  22.352
   82    H2*    A   8           H2*        A   8  -8.720  -3.297  21.631
   83   2HO*    A   8          2HO*        A   8 -11.016  -3.941  20.991
   84    H1*    A   8           H1*        A   8  -8.661  -2.645  18.973
   85    H8     A   8           H8         A   8  -7.635   0.581  20.583
   86   1H6     A   8          1H6         A   8  -1.923  -1.920  20.516
   87   2H6     A   8          2H6         A   8  -2.829  -0.417  20.625
   88    H2     A   8           H2         A   8  -4.854  -5.191  20.014
   89   1H5*    C   9          1H5*        C   9 -10.993  -5.208  22.540
   90   2H5*    C   9          2H5*        C   9 -11.421  -5.603  24.216
   91    H4*    C   9           H4*        C   9  -9.698  -7.150  23.405
   92    H3*    C   9           H3*        C   9  -8.658  -5.125  25.432
   93    H2*    C   9           H2*        C   9  -6.630  -6.375  25.449
   94   2HO*    C   9          2HO*        C   9  -7.935  -8.429  25.252
   95    H1*    C   9           H1*        C   9  -6.595  -6.719  22.695
   96   1H4     C   9          2H4         C   9  -2.818  -1.774  23.658
   97   2H4     C   9          1H4         C   9  -4.167  -0.645  23.808
   98    H5     C   9           H5         C   9  -6.516  -1.453  23.859
   99    H6     C   9           H6         C   9  -7.907  -3.413  23.670
  100    H3T    C   9           H3T        C   9 -10.256  -6.528  26.226
  101   1H5*    G  10          1H5*        G  10   7.047  -4.989  22.202
  102   2H5*    G  10          2H5*        G  10   7.236  -6.273  21.000
  103    H4*    G  10           H4*        G  10   6.154  -7.373  22.732
  104    H3*    G  10           H3*        G  10   3.961  -6.399  20.872
  105    H2*    G  10           H2*        G  10   2.408  -7.567  22.181
  106   2HO*    G  10          2HO*        G  10   4.017  -9.344  22.547
  107    H1*    G  10           H1*        G  10   3.405  -6.680  24.556
  108    H8     G  10           H8         G  10   4.046  -3.540  22.908
  109    H1     G  10           H1         G  10  -2.283  -4.572  23.430
  110   1H2     G  10          2H2         G  10  -2.663  -6.771  23.594
  111   2H2     G  10          1H2         G  10  -1.332  -7.920  23.739
  112    H5T    G  10           H5T        G  10   5.567  -5.456  19.817
  113   1H5*    U  11          1H5*        U  11   3.246 -10.271  20.056
  114   2H5*    U  11          2H5*        U  11   3.042 -10.526  18.315
  115    H4*    U  11           H4*        U  11   0.945 -10.876  19.549
  116    H3*    U  11           H3*        U  11   0.974  -8.447  17.742
  117    H2*    U  11           H2*        U  11  -1.373  -8.229  18.266
  118   2HO*    U  11          2HO*        U  11  -1.625 -10.622  18.279
  119    H1*    U  11           H1*        U  11  -1.086  -8.642  20.925
  120    H3     U  11           H3         U  11  -2.130  -4.249  20.144
  121    H5     U  11           H5         U  11   2.060  -4.452  19.868
  122    H6     U  11           H6         U  11   1.903  -6.863  19.980
  123   1H5*    C  12          1H5*        C  12  -2.591 -10.758  16.672
  124   2H5*    C  12          2H5*        C  12  -2.871 -10.611  14.930
  125    H4*    C  12           H4*        C  12  -4.769  -9.815  16.399
  126    H3*    C  12           H3*        C  12  -3.487  -7.884  14.453
  127    H2*    C  12           H2*        C  12  -5.191  -6.307  15.090
  128   2HO*    C  12          2HO*        C  12  -6.755  -8.202  15.243
  129    H1*    C  12           H1*        C  12  -5.094  -6.877  17.783
  130   1H4     C  12          2H4         C  12  -1.775  -1.625  17.197
  131   2H4     C  12          1H4         C  12  -0.246  -2.498  17.037
  132    H5     C  12           H5         C  12  -0.237  -4.988  16.720
  133    H6     C  12           H6         C  12  -1.650  -6.948  16.681
  134   1H5*    G  13          1H5*        G  13  -7.449  -6.863  13.728
  135   2H5*    G  13          2H5*        G  13  -7.672  -6.811  11.972
  136    H4*    G  13           H4*        G  13  -8.109  -4.620  12.943
  137    H3*    G  13           H3*        G  13  -5.594  -4.787  11.274
  138    H2*    G  13           H2*        G  13  -5.400  -2.419  11.487
  139   2HO*    G  13          2HO*        G  13  -7.698  -1.997  11.258
  140    H1*    G  13           H1*        G  13  -5.969  -2.369  14.178
  141    H8     G  13           H8         G  13  -3.955  -5.461  13.111
  142    H1     G  13           H1         G  13  -0.339  -0.274  14.215
  143   1H2     G  13          1H2         G  13  -1.621   1.485  14.624
  144   2H2     G  13          2H2         G  13  -3.361   1.407  14.544
  145   1H5*    A  14          1H5*        A  14  -7.633  -1.417   7.398
  146   2H5*    A  14          2H5*        A  14  -6.485  -0.864   8.643
  147    H4*    A  14           H4*        A  14  -9.489  -0.300   8.648
  148    H3*    A  14           H3*        A  14  -7.116   1.327   7.710
  149    H2*    A  14           H2*        A  14  -8.216   3.308   8.511
  150   2HO*    A  14          2HO*        A  14 -10.356   2.292   7.846
  151    H1*    A  14           H1*        A  14  -8.918   2.240  10.923
  152    H8     A  14           H8         A  14  -5.672   0.535  10.594
  153   1H6     A  14          1H6         A  14  -3.022   6.048  11.803
  154   2H6     A  14          2H6         A  14  -2.696   4.320  11.637
  155    H2     A  14           H2         A  14  -7.224   6.763  10.709
  156   1H5*    A  15          1H5*        A  15  -9.651   4.155   6.491
  157   2H5*    A  15          2H5*        A  15  -9.324   4.505   4.783
  158    H4*    A  15           H4*        A  15  -9.004   6.507   6.136
  159    H3*    A  15           H3*        A  15  -6.472   5.330   4.967
  160    H2*    A  15           H2*        A  15  -5.310   7.267   5.826
  161   2HO*    A  15          2HO*        A  15  -7.316   8.601   5.347
  162    H1*    A  15           H1*        A  15  -6.446   7.176   8.290
  163    H8     A  15           H8         A  15  -6.189   3.564   7.447
  164   1H6     A  15          1H6         A  15  -0.104   4.013   8.615
  165   2H6     A  15          2H6         A  15  -1.417   2.882   8.259
  166    H2     A  15           H2         A  15  -1.772   8.079   8.621
  167   1H5*    G  16          1H5*        G  16  -6.072   9.412   4.010
  168   2H5*    G  16          2H5*        G  16  -5.541   9.560   2.328
  169    H4*    G  16           H4*        G  16  -3.990  10.641   3.942
  170    H3*    G  16           H3*        G  16  -2.939   8.297   2.341
  171    H2*    G  16           H2*        G  16  -0.762   8.837   3.250
  172   2HO*    G  16          2HO*        G  16  -1.378  11.208   3.141
  173    H1*    G  16           H1*        G  16  -1.662   9.182   5.812
  174    H8     G  16           H8         G  16  -3.703   6.278   4.583
  175    H1     G  16           H1         G  16   2.458   4.721   5.597
  176   1H2     G  16          2H2         G  16   3.710   6.594   5.569
  177   2H2     G  16          1H2         G  16   2.936   8.177   5.567
  178   1H5*    C  17          1H5*        C  17  -0.063  11.400   1.711
  179   2H5*    C  17          2H5*        C  17   0.356  11.457  -0.010
  180    H4*    C  17           H4*        C  17   2.340  11.125   1.446
  181    H3*    C  17           H3*        C  17   1.605   8.863  -0.430
  182    H2*    C  17           H2*        C  17   3.694   7.843   0.211
  183   2HO*    C  17          2HO*        C  17   4.691  10.071   0.304
  184    H1*    C  17           H1*        C  17   3.403   8.408   2.890
  185   1H4     C  17          2H4         C  17   1.429   2.450   2.406
  186   2H4     C  17          1H4         C  17  -0.235   2.971   2.164
  187    H5     C  17           H5         C  17  -0.802   5.344   1.716
  188    H6     C  17           H6         C  17   0.095   7.585   1.633
  189   1H5*    C  18          1H5*        C  18   5.850   9.829  -1.224
  190   2H5*    C  18          2H5*        C  18   6.057   9.819  -2.986
  191    H4*    C  18           H4*        C  18   7.650   8.284  -1.858
  192    H3*    C  18           H3*        C  18   5.524   6.995  -3.609
  193    H2*    C  18           H2*        C  18   6.636   4.926  -3.273
  194   2HO*    C  18          2HO*        C  18   8.706   4.826  -2.297
  195    H1*    C  18           H1*        C  18   7.248   5.426  -0.577
  196   1H4     C  18          2H4         C  18   2.395   1.420  -0.460
  197   2H4     C  18          1H4         C  18   1.219   2.720  -0.634
  198    H5     C  18           H5         C  18   1.929   5.041  -1.175
  199    H6     C  18           H6         C  18   3.852   6.480  -1.469
  200    H3T    C  18           H3T        C  18   8.272   7.184  -4.108
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1   5.666  -8.730   0.990
    2   2H5*    G   1          2H5*        G   1   6.115  -8.416   2.678
    3    H4*    G   1           H4*        G   1   7.762  -7.444   1.161
    4    H3*    G   1           H3*        G   1   6.069  -5.427   2.658
    5    H2*    G   1           H2*        G   1   7.537  -3.737   1.763
    6   2HO*    G   1          2HO*        G   1   9.418  -5.244   1.965
    7    H1*    G   1           H1*        G   1   7.486  -4.722  -0.781
    8    H8     G   1           H8         G   1   4.000  -5.418   0.378
    9    H1     G   1           H1         G   1   5.040   0.854  -0.624
   10   1H2     G   1          2H2         G   1   7.245   1.226  -0.788
   11   2H2     G   1          1H2         G   1   8.398  -0.108  -0.716
   12    H5T    G   1           H5T        G   1   3.947  -7.979   2.464
   13   1H5*    G   2          1H5*        G   2  10.124  -4.272   3.521
   14   2H5*    G   2          2H5*        G   2  10.223  -3.767   5.217
   15    H4*    G   2           H4*        G   2  10.938  -2.007   3.594
   16    H3*    G   2           H3*        G   2   8.533  -1.423   5.337
   17    H2*    G   2           H2*        G   2   8.614   0.822   4.440
   18   2HO*    G   2          2HO*        G   2  11.042   0.706   4.405
   19    H1*    G   2           H1*        G   2   8.949   0.031   1.856
   20    H8     G   2           H8         G   2   6.542  -2.490   3.327
   21    H1     G   2           H1         G   2   3.919   3.314   2.445
   22   1H2     G   2          2H2         G   2   5.576   4.840   2.197
   23   2H2     G   2          1H2         G   2   7.255   4.312   2.076
   24   1H5*    C   3          1H5*        C   3  11.212   1.971   5.815
   25   2H5*    C   3          2H5*        C   3  11.204   2.493   7.508
   26    H4*    C   3           H4*        C   3  10.560   4.285   5.868
   27    H3*    C   3           H3*        C   3   8.510   3.458   7.944
   28    H2*    C   3           H2*        C   3   7.211   5.325   7.138
   29   2HO*    C   3          2HO*        C   3   9.273   6.580   6.805
   30    H1*    C   3           H1*        C   3   7.642   4.803   4.492
   31   1H4     C   3          2H4         C   3   2.040   2.201   5.726
   32   2H4     C   3          1H4         C   3   2.803   0.631   5.947
   33    H5     C   3           H5         C   3   5.246   0.386   6.224
   34    H6     C   3           H6         C   3   7.350   1.548   6.032
   35   1H5*    U   4          1H5*        U   4   7.908   7.416   8.348
   36   2H5*    U   4          2H5*        U   4   7.825   7.842  10.067
   37    H4*    U   4           H4*        U   4   5.675   8.263   8.917
   38    H3*    U   4           H3*        U   4   5.598   5.917  10.822
   39    H2*    U   4           H2*        U   4   3.212   6.000  10.637
   40   2HO*    U   4          2HO*        U   4   2.962   8.325  10.318
   41    H1*    U   4           H1*        U   4   3.386   6.071   7.917
   42    H3     U   4           H3         U   4   2.051   1.873   9.234
   43    H5     U   4           H5         U   4   6.244   1.785   9.402
   44    H6     U   4           H6         U   4   6.277   4.158   8.980
   45   1H5*    A   5          1H5*        A   5   2.832   9.018  13.964
   46   2H5*    A   5          2H5*        A   5   3.331   7.458  13.283
   47    H4*    A   5           H4*        A   5   0.677   8.846  12.691
   48    H3*    A   5           H3*        A   5   1.477   6.586  14.549
   49    H2*    A   5           H2*        A   5  -0.678   5.607  14.192
   50   2HO*    A   5          2HO*        A   5  -1.863   7.620  14.168
   51    H1*    A   5           H1*        A   5  -0.614   5.958  11.474
   52    H8     A   5           H8         A   5   2.892   5.216  12.878
   53   1H6     A   5          1H6         A   5   1.423  -0.744  11.849
   54   2H6     A   5          2H6         A   5   2.752   0.340  12.243
   55    H2     A   5           H2         A   5  -2.195   1.643  11.208
   56   1H5*    A   6          1H5*        A   6  -2.884   7.652  17.863
   57   2H5*    A   6          2H5*        A   6  -2.769   6.207  16.830
   58    H4*    A   6           H4*        A   6  -4.374   8.725  16.172
   59    H3*    A   6           H3*        A   6  -5.143   6.034  17.316
   60    H2*    A   6           H2*        A   6  -7.228   6.175  16.139
   61   2HO*    A   6          2HO*        A   6  -7.204   8.600  16.499
   62    H1*    A   6           H1*        A   6  -6.086   6.877  13.773
   63    H8     A   6           H8         A   6  -3.332   4.732  14.820
   64   1H6     A   6          1H6         A   6  -6.981  -0.135  13.491
   65   2H6     A   6          2H6         A   6  -5.326   0.314  13.886
   66    H2     A   6           H2         A   6  -9.539   3.422  13.733
   67   1H5*    G   7          1H5*        G   7  -8.456   6.897  18.330
   68   2H5*    G   7          2H5*        G   7  -8.822   6.481  20.017
   69    H4*    G   7           H4*        G   7  -9.990   5.009  18.406
   70    H3*    G   7           H3*        G   7  -7.857   3.638  20.070
   71    H2*    G   7           H2*        G   7  -8.688   1.569  19.094
   72   2HO*    G   7          2HO*        G   7 -10.944   2.518  19.081
   73    H1*    G   7           H1*        G   7  -8.701   2.537  16.555
   74    H8     G   7           H8         G   7  -5.712   4.197  18.153
   75    H1     G   7           H1         G   7  -4.772  -2.055  16.988
   76   1H2     G   7          2H2         G   7  -6.729  -3.042  16.603
   77   2H2     G   7          1H2         G   7  -8.218  -2.098  16.484
   78   1H5*    A   8          1H5*        A   8 -11.383   1.266  20.399
   79   2H5*    A   8          2H5*        A   8 -11.593   0.660  22.047
   80    H4*    A   8           H4*        A   8 -11.504  -1.117  20.263
   81    H3*    A   8           H3*        A   8  -9.465  -1.143  22.496
   82    H2*    A   8           H2*        A   8  -8.718  -3.287  21.601
   83   2HO*    A   8          2HO*        A   8 -11.093  -3.698  20.986
   84    H1*    A   8           H1*        A   8  -8.699  -2.457  19.000
   85    H8     A   8           H8         A   8  -7.460   0.650  20.636
   86   1H6     A   8          1H6         A   8  -1.891  -2.126  20.325
   87   2H6     A   8          2H6         A   8  -2.723  -0.582  20.451
   88    H2     A   8           H2         A   8  -5.003  -5.257  19.977
   89   1H5*    C   9          1H5*        C   9 -11.140  -4.960  22.392
   90   2H5*    C   9          2H5*        C   9 -11.635  -5.576  23.976
   91    H4*    C   9           H4*        C   9  -9.990  -7.038  22.733
   92    H3*    C   9           H3*        C   9 -10.039  -6.553  25.474
   93    H2*    C   9           H2*        C   9  -8.348  -4.886  25.429
   94   2HO*    C   9          2HO*        C   9  -6.357  -5.940  26.054
   95    H1*    C   9           H1*        C   9  -6.891  -6.608  23.393
   96   1H4     C   9          2H4         C   9  -2.857  -1.741  23.456
   97   2H4     C   9          1H4         C   9  -4.129  -0.521  23.565
   98    H5     C   9           H5         C   9  -6.521  -1.172  23.744
   99    H6     C   9           H6         C   9  -8.039  -3.055  23.735
  100    H3T    C   9           H3T        C   9  -8.191  -8.191  25.305
  101   1H5*    G  10          1H5*        G  10   6.811  -5.629  22.156
  102   2H5*    G  10          2H5*        G  10   6.947  -6.913  20.947
  103    H4*    G  10           H4*        G  10   5.752  -7.950  22.646
  104    H3*    G  10           H3*        G  10   3.677  -6.835  20.731
  105    H2*    G  10           H2*        G  10   2.016  -7.907  22.000
  106   2HO*    G  10          2HO*        G  10   3.494  -9.784  22.398
  107    H1*    G  10           H1*        G  10   3.005  -7.088  24.398
  108    H8     G  10           H8         G  10   3.879  -4.008  22.696
  109    H1     G  10           H1         G  10  -2.499  -4.594  23.323
  110   1H2     G  10          2H2         G  10  -3.024  -6.758  23.552
  111   2H2     G  10          1H2         G  10  -1.772  -7.996  23.664
  112    H5T    G  10           H5T        G  10   5.372  -5.981  19.730
  113   1H5*    U  11          1H5*        U  11   2.844 -10.714  19.778
  114   2H5*    U  11          2H5*        U  11   2.618 -10.890  18.030
  115    H4*    U  11           H4*        U  11   0.513 -11.165  19.281
  116    H3*    U  11           H3*        U  11   0.654  -8.692  17.539
  117    H2*    U  11           H2*        U  11  -1.680  -8.378  18.090
  118   2HO*    U  11          2HO*        U  11  -2.042 -10.758  18.054
  119    H1*    U  11           H1*        U  11  -1.378  -8.862  20.736
  120    H3     U  11           H3         U  11  -2.216  -4.412  20.032
  121    H5     U  11           H5         U  11   1.951  -4.810  19.648
  122    H6     U  11           H6         U  11   1.683  -7.212  19.762
  123   1H5*    C  12          1H5*        C  12  -3.039 -10.785  16.464
  124   2H5*    C  12          2H5*        C  12  -3.334 -10.583  14.730
  125    H4*    C  12           H4*        C  12  -5.173  -9.737  16.246
  126    H3*    C  12           H3*        C  12  -3.835  -7.822  14.323
  127    H2*    C  12           H2*        C  12  -5.469  -6.193  15.014
  128   2HO*    C  12          2HO*        C  12  -7.105  -8.025  15.151
  129    H1*    C  12           H1*        C  12  -5.354  -6.818  17.694
  130   1H4     C  12          2H4         C  12  -1.828  -1.692  17.088
  131   2H4     C  12          1H4         C  12  -0.340  -2.629  16.909
  132    H5     C  12           H5         C  12  -0.438  -5.115  16.584
  133    H6     C  12           H6         C  12  -1.931  -7.015  16.558
  134   1H5*    G  13          1H5*        G  13  -7.749  -6.619  13.669
  135   2H5*    G  13          2H5*        G  13  -7.995  -6.521  11.919
  136    H4*    G  13           H4*        G  13  -8.322  -4.335  12.946
  137    H3*    G  13           H3*        G  13  -5.847  -4.571  11.226
  138    H2*    G  13           H2*        G  13  -5.551  -2.217  11.485
  139   2HO*    G  13          2HO*        G  13  -7.830  -1.691  11.313
  140    H1*    G  13           H1*        G  13  -6.064  -2.205  14.188
  141    H8     G  13           H8         G  13  -4.206  -5.361  13.038
  142    H1     G  13           H1         G  13  -0.352  -0.335  14.087
  143   1H2     G  13          1H2         G  13  -1.549   1.468  14.551
  144   2H2     G  13          2H2         G  13  -3.293   1.461  14.526
  145   1H5*    A  14          1H5*        A  14  -7.803  -1.011   7.479
  146   2H5*    A  14          2H5*        A  14  -6.604  -0.552   8.714
  147    H4*    A  14           H4*        A  14  -9.577   0.149   8.811
  148    H3*    A  14           H3*        A  14  -7.160   1.701   7.856
  149    H2*    A  14           H2*        A  14  -8.167   3.702   8.731
  150   2HO*    A  14          2HO*        A  14 -10.358   2.784   8.090
  151    H1*    A  14           H1*        A  14  -8.856   2.594  11.130
  152    H8     A  14           H8         A  14  -5.676   0.795  10.673
  153   1H6     A  14          1H6         A  14  -2.822   6.192  11.955
  154   2H6     A  14          2H6         A  14  -2.554   4.460  11.739
  155    H2     A  14           H2         A  14  -7.023   7.064  10.985
  156   1H5*    A  15          1H5*        A  15  -9.593   4.671   6.801
  157   2H5*    A  15          2H5*        A  15  -9.308   5.053   5.093
  158    H4*    A  15           H4*        A  15  -8.858   7.003   6.485
  159    H3*    A  15           H3*        A  15  -6.429   5.750   5.188
  160    H2*    A  15           H2*        A  15  -5.139   7.593   6.054
  161   2HO*    A  15          2HO*        A  15  -7.086   9.042   5.675
  162    H1*    A  15           H1*        A  15  -6.203   7.513   8.556
  163    H8     A  15           H8         A  15  -6.128   3.911   7.635
  164   1H6     A  15          1H6         A  15   0.001   4.079   8.657
  165   2H6     A  15          2H6         A  15  -1.365   3.011   8.308
  166    H2     A  15           H2         A  15  -1.493   8.209   8.787
  167   1H5*    G  16          1H5*        G  16  -5.830   9.827   4.306
  168   2H5*    G  16          2H5*        G  16  -5.365   9.971   2.603
  169    H4*    G  16           H4*        G  16  -3.658  10.910   4.148
  170    H3*    G  16           H3*        G  16  -2.860   8.483   2.531
  171    H2*    G  16           H2*        G  16  -0.623   8.868   3.313
  172   2HO*    G  16          2HO*        G  16   0.006  10.674   4.382
  173    H1*    G  16           H1*        G  16  -1.401   9.306   5.919
  174    H8     G  16           H8         G  16  -3.591   6.483   4.744
  175    H1     G  16           H1         G  16   2.541   4.725   5.622
  176   1H2     G  16          2H2         G  16   3.848   6.560   5.584
  177   2H2     G  16          1H2         G  16   3.125   8.165   5.614
  178   1H5*    C  17          1H5*        C  17   0.067  11.463   1.795
  179   2H5*    C  17          2H5*        C  17   0.494  11.520   0.077
  180    H4*    C  17           H4*        C  17   2.473  11.175   1.542
  181    H3*    C  17           H3*        C  17   1.729   8.934  -0.355
  182    H2*    C  17           H2*        C  17   3.801   7.881   0.287
  183   2HO*    C  17          2HO*        C  17   4.801  10.123   0.426
  184    H1*    C  17           H1*        C  17   3.508   8.414   2.968
  185   1H4     C  17          2H4         C  17   1.422   2.505   2.454
  186   2H4     C  17          1H4         C  17  -0.234   3.061   2.229
  187    H5     C  17           H5         C  17  -0.755   5.448   1.788
  188    H6     C  17           H6         C  17   0.189   7.665   1.696
  189   1H5*    C  18          1H5*        C  18   5.983   9.696  -1.078
  190   2H5*    C  18          2H5*        C  18   6.181   9.796  -2.836
  191    H4*    C  18           H4*        C  18   7.717   8.130  -1.918
  192    H3*    C  18           H3*        C  18   5.402   6.916  -3.486
  193    H2*    C  18           H2*        C  18   6.578   4.849  -3.335
  194   2HO*    C  18          2HO*        C  18   8.678   6.054  -3.630
  195    H1*    C  18           H1*        C  18   7.316   5.249  -0.678
  196   1H4     C  18          2H4         C  18   2.300   1.443  -0.436
  197   2H4     C  18          1H4         C  18   1.162   2.785  -0.560
  198    H5     C  18           H5         C  18   1.948   5.093  -1.075
  199    H6     C  18           H6         C  18   3.917   6.462  -1.391
  200    H3T    C  18           H3T        C  18   6.727   8.295  -4.703
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1   5.230  -8.383  -0.364
    2   2H5*    G   1          2H5*        G   1   5.883  -8.416   1.282
    3    H4*    G   1           H4*        G   1   7.472  -7.279  -0.107
    4    H3*    G   1           H3*        G   1   5.900  -5.314   1.584
    5    H2*    G   1           H2*        G   1   7.430  -3.635   0.825
    6   2HO*    G   1          2HO*        G   1   9.250  -5.222   0.842
    7    H1*    G   1           H1*        G   1   7.247  -4.381  -1.792
    8    H8     G   1           H8         G   1   3.780  -5.094  -0.629
    9    H1     G   1           H1         G   1   4.961   1.223  -0.987
   10   1H2     G   1          2H2         G   1   7.173   1.562  -1.120
   11   2H2     G   1          1H2         G   1   8.295   0.201  -1.203
   12    H5T    G   1           H5T        G   1   4.477  -6.774   1.856
   13   1H5*    G   2          1H5*        G   2   9.882  -4.446   2.597
   14   2H5*    G   2          2H5*        G   2  10.005  -4.134   4.337
   15    H4*    G   2           H4*        G   2  10.782  -2.234   2.924
   16    H3*    G   2           H3*        G   2   8.382  -1.756   4.703
   17    H2*    G   2           H2*        G   2   8.536   0.564   4.047
   18   2HO*    G   2          2HO*        G   2  10.964   0.373   4.012
   19    H1*    G   2           H1*        G   2   8.877   0.044   1.399
   20    H8     G   2           H8         G   2   6.381  -2.545   2.553
   21    H1     G   2           H1         G   2   3.955   3.409   2.268
   22   1H2     G   2          2H2         G   2   5.667   4.893   2.200
   23   2H2     G   2          1H2         G   2   7.332   4.322   2.062
   24   1H5*    C   3          1H5*        C   3  11.162   1.500   5.508
   25   2H5*    C   3          2H5*        C   3  11.184   1.819   7.249
   26    H4*    C   3           H4*        C   3  10.610   3.820   5.855
   27    H3*    C   3           H3*        C   3   8.526   2.813   7.814
   28    H2*    C   3           H2*        C   3   7.301   4.814   7.271
   29   2HO*    C   3          2HO*        C   3   9.430   6.009   7.109
   30    H1*    C   3           H1*        C   3   7.746   4.658   4.574
   31   1H4     C   3          2H4         C   3   1.972   2.099   5.404
   32   2H4     C   3          1H4         C   3   2.729   0.531   5.545
   33    H5     C   3           H5         C   3   5.119   0.175   5.739
   34    H6     C   3           H6         C   3   7.276   1.249   5.687
   35   1H5*    U   4          1H5*        U   4   8.343   6.800   8.782
   36   2H5*    U   4          2H5*        U   4   8.262   6.978  10.543
   37    H4*    U   4           H4*        U   4   6.232   7.844   9.432
   38    H3*    U   4           H3*        U   4   5.821   5.375  11.139
   39    H2*    U   4           H2*        U   4   3.448   5.726  10.778
   40   2HO*    U   4          2HO*        U   4   3.731   8.108  10.839
   41    H1*    U   4           H1*        U   4   3.710   6.175   8.097
   42    H3     U   4           H3         U   4   1.744   2.068   8.728
   43    H5     U   4           H5         U   4   5.865   1.344   9.049
   44    H6     U   4           H6         U   4   6.255   3.722   8.978
   45   1H5*    A   5          1H5*        A   5   2.956   8.428  12.441
   46   2H5*    A   5          2H5*        A   5   2.730   8.296  14.191
   47    H4*    A   5           H4*        A   5   0.608   8.075  12.926
   48    H3*    A   5           H3*        A   5   1.501   5.592  14.422
   49    H2*    A   5           H2*        A   5  -0.705   4.734  13.928
   50   2HO*    A   5          2HO*        A   5  -1.793   6.816  14.190
   51    H1*    A   5           H1*        A   5  -0.578   5.468  11.286
   52    H8     A   5           H8         A   5   2.903   4.453  12.521
   53   1H6     A   5          1H6         A   5   1.118  -1.396  11.436
   54   2H6     A   5          2H6         A   5   2.514  -0.369  11.753
   55    H2     A   5           H2         A   5  -2.427   1.163  11.033
   56   1H5*    A   6          1H5*        A   6  -1.788   8.701  15.674
   57   2H5*    A   6          2H5*        A   6  -2.224   8.464  17.378
   58    H4*    A   6           H4*        A   6  -4.138   9.167  15.923
   59    H3*    A   6           H3*        A   6  -4.318   6.469  17.288
   60    H2*    A   6           H2*        A   6  -6.584   6.380  16.452
   61   2HO*    A   6          2HO*        A   6  -6.756   8.793  16.802
   62    H1*    A   6           H1*        A   6  -5.941   7.180  13.925
   63    H8     A   6           H8         A   6  -3.036   5.016  14.973
   64   1H6     A   6          1H6         A   6  -6.707   0.200  13.606
   65   2H6     A   6          2H6         A   6  -5.055   0.652  14.017
   66    H2     A   6           H2         A   6  -9.235   3.794  13.758
   67   1H5*    G   7          1H5*        G   7  -7.978   7.349  18.293
   68   2H5*    G   7          2H5*        G   7  -8.275   6.962  19.999
   69    H4*    G   7           H4*        G   7  -9.601   5.545  18.459
   70    H3*    G   7           H3*        G   7  -7.500   4.094  20.088
   71    H2*    G   7           H2*        G   7  -8.444   2.046  19.175
   72   2HO*    G   7          2HO*        G   7 -10.655   3.103  19.185
   73    H1*    G   7           H1*        G   7  -8.464   2.937  16.616
   74    H8     G   7           H8         G   7  -5.375   4.546  18.084
   75    H1     G   7           H1         G   7  -4.706  -1.783  17.149
   76   1H2     G   7          2H2         G   7  -6.688  -2.689  16.703
   77   2H2     G   7          1H2         G   7  -8.134  -1.686  16.550
   78   1H5*    A   8          1H5*        A   8 -11.177   1.933  20.512
   79   2H5*    A   8          2H5*        A   8 -11.382   1.321  22.157
   80    H4*    A   8           H4*        A   8 -11.429  -0.424  20.322
   81    H3*    A   8           H3*        A   8  -9.417  -0.630  22.568
   82    H2*    A   8           H2*        A   8  -8.805  -2.801  21.637
   83   2HO*    A   8          2HO*        A   8 -11.198  -3.037  20.993
   84    H1*    A   8           H1*        A   8  -8.703  -1.931  19.053
   85    H8     A   8           H8         A   8  -7.283   1.063  20.747
   86   1H6     A   8          1H6         A   8  -1.902  -2.064  20.512
   87   2H6     A   8          2H6         A   8  -2.637  -0.474  20.649
   88    H2     A   8           H2         A   8  -5.202  -4.980  20.022
   89   1H5*    C   9          1H5*        C   9 -11.358  -4.321  22.371
   90   2H5*    C   9          2H5*        C   9 -11.911  -4.935  23.936
   91    H4*    C   9           H4*        C   9 -10.358  -6.480  22.675
   92    H3*    C   9           H3*        C   9 -10.403  -6.057  25.425
   93    H2*    C   9           H2*        C   9  -8.606  -4.505  25.437
   94   2HO*    C   9          2HO*        C   9  -6.697  -5.702  26.058
   95    H1*    C   9           H1*        C   9  -7.238  -6.271  23.378
   96   1H4     C   9          2H4         C   9  -2.906  -1.670  23.624
   97   2H4     C   9          1H4         C   9  -4.101  -0.375  23.739
   98    H5     C   9           H5         C   9  -6.532  -0.877  23.862
   99    H6     C   9           H6         C   9  -8.165  -2.660  23.786
  100    H3T    C   9           H3T        C   9  -8.664  -7.810  25.235
  101   1H5*    G  10          1H5*        G  10   6.535  -6.112  22.679
  102   2H5*    G  10          2H5*        G  10   6.653  -7.372  21.443
  103    H4*    G  10           H4*        G  10   5.327  -8.381  23.058
  104    H3*    G  10           H3*        G  10   3.405  -7.101  21.085
  105    H2*    G  10           H2*        G  10   1.630  -8.103  22.251
  106   2HO*    G  10          2HO*        G  10   2.981 -10.071  22.667
  107    H1*    G  10           H1*        G  10   2.550  -7.395  24.710
  108    H8     G  10           H8         G  10   3.696  -4.339  23.129
  109    H1     G  10           H1         G  10  -2.729  -4.539  23.440
  110   1H2     G  10          2H2         G  10  -3.397  -6.671  23.589
  111   2H2     G  10          1H2         G  10  -2.229  -7.988  23.721
  112    H5T    G  10           H5T        G  10   5.188  -6.323  20.183
  113   1H5*    U  11          1H5*        U  11   2.360 -10.880  20.022
  114   2H5*    U  11          2H5*        U  11   2.237 -11.017  18.261
  115    H4*    U  11           H4*        U  11   0.042 -11.188  19.357
  116    H3*    U  11           H3*        U  11   0.443  -8.680  17.708
  117    H2*    U  11           H2*        U  11  -1.903  -8.247  18.109
  118   2HO*    U  11          2HO*        U  11  -2.409 -10.586  17.964
  119    H1*    U  11           H1*        U  11  -1.810  -8.826  20.752
  120    H3     U  11           H3         U  11  -2.354  -4.316  20.161
  121    H5     U  11           H5         U  11   1.801  -4.937  19.999
  122    H6     U  11           H6         U  11   1.399  -7.322  20.028
  123   1H5*    C  12          1H5*        C  12  -3.271 -10.573  16.300
  124   2H5*    C  12          2H5*        C  12  -3.420 -10.297  14.557
  125    H4*    C  12           H4*        C  12  -5.342  -9.429  15.940
  126    H3*    C  12           H3*        C  12  -3.757  -7.476  14.253
  127    H2*    C  12           H2*        C  12  -5.401  -5.828  14.873
  128   2HO*    C  12          2HO*        C  12  -7.100  -7.600  14.758
  129    H1*    C  12           H1*        C  12  -5.550  -6.592  17.517
  130   1H4     C  12          2H4         C  12  -1.806  -1.558  17.387
  131   2H4     C  12          1H4         C  12  -0.346  -2.542  17.240
  132    H5     C  12           H5         C  12  -0.507  -5.000  16.800
  133    H6     C  12           H6         C  12  -2.054  -6.847  16.602
  134   1H5*    G  13          1H5*        G  13  -7.542  -6.125  13.279
  135   2H5*    G  13          2H5*        G  13  -7.614  -5.917  11.523
  136    H4*    G  13           H4*        G  13  -8.000  -3.795  12.659
  137    H3*    G  13           H3*        G  13  -5.378  -3.953  11.155
  138    H2*    G  13           H2*        G  13  -5.150  -1.593  11.580
  139   2HO*    G  13          2HO*        G  13  -7.459  -1.153  11.288
  140    H1*    G  13           H1*        G  13  -5.818  -1.792  14.231
  141    H8     G  13           H8         G  13  -3.941  -4.920  13.079
  142    H1     G  13           H1         G  13  -0.057  -0.055  14.646
  143   1H2     G  13          1H2         G  13  -1.240   1.793  15.014
  144   2H2     G  13          2H2         G  13  -2.968   1.838  14.790
  145   1H5*    A  14          1H5*        A  14  -9.321  -1.687   9.794
  146   2H5*    A  14          2H5*        A  14  -9.182  -1.369   8.054
  147    H4*    A  14           H4*        A  14 -10.397   0.413   9.309
  148    H3*    A  14           H3*        A  14  -7.839   1.152   7.882
  149    H2*    A  14           H2*        A  14  -8.227   3.419   8.533
  150   2HO*    A  14          2HO*        A  14 -10.520   3.310   8.062
  151    H1*    A  14           H1*        A  14  -9.101   2.857  11.085
  152    H8     A  14           H8         A  14  -6.152   0.594  10.482
  153   1H6     A  14          1H6         A  14  -2.755   5.654  11.875
  154   2H6     A  14          2H6         A  14  -2.644   3.915  11.601
  155    H2     A  14           H2         A  14  -6.858   6.943  11.020
  156   1H5*    A  15          1H5*        A  15  -8.120   4.395   4.443
  157   2H5*    A  15          2H5*        A  15  -7.094   3.795   5.753
  158    H4*    A  15           H4*        A  15  -8.880   6.263   5.967
  159    H3*    A  15           H3*        A  15  -6.032   5.847   5.084
  160    H2*    A  15           H2*        A  15  -5.278   7.758   6.298
  161   2HO*    A  15          2HO*        A  15  -7.466   8.810   5.758
  162    H1*    A  15           H1*        A  15  -6.565   7.178   8.604
  163    H8     A  15           H8         A  15  -6.051   3.722   7.679
  164   1H6     A  15          1H6         A  15   0.039   4.396   8.703
  165   2H6     A  15          2H6         A  15  -1.245   3.222   8.380
  166    H2     A  15           H2         A  15  -1.800   8.389   8.851
  167   1H5*    G  16          1H5*        G  16  -5.681   9.701   4.628
  168   2H5*    G  16          2H5*        G  16  -5.218  10.098   2.962
  169    H4*    G  16           H4*        G  16  -3.532  10.878   4.573
  170    H3*    G  16           H3*        G  16  -2.699   8.652   2.703
  171    H2*    G  16           H2*        G  16  -0.470   8.860   3.602
  172   2HO*    G  16          2HO*        G  16  -0.832  11.276   3.769
  173    H1*    G  16           H1*        G  16  -1.251   8.990   6.211
  174    H8     G  16           H8         G  16  -3.703   6.541   4.811
  175    H1     G  16           H1         G  16   2.177   4.050   5.579
  176   1H2     G  16          1H2         G  16   3.613   5.510   5.620
  177   2H2     G  16          2H2         G  16   3.390   7.195   5.599
  178   1H5*    C  17          1H5*        C  17   0.383  11.674   2.330
  179   2H5*    C  17          2H5*        C  17   0.768  11.877   0.612
  180    H4*    C  17           H4*        C  17   2.763  11.299   1.978
  181    H3*    C  17           H3*        C  17   1.863   9.274  -0.088
  182    H2*    C  17           H2*        C  17   3.897   8.076   0.403
  183   2HO*    C  17          2HO*        C  17   5.036  10.216   0.670
  184    H1*    C  17           H1*        C  17   3.699   8.412   3.130
  185   1H4     C  17          2H4         C  17   1.388   2.636   2.218
  186   2H4     C  17          1H4         C  17  -0.250   3.259   2.032
  187    H5     C  17           H5         C  17  -0.685   5.693   1.757
  188    H6     C  17           H6         C  17   0.342   7.880   1.826
  189   1H5*    C  18          1H5*        C  18   6.157  10.115  -0.893
  190   2H5*    C  18          2H5*        C  18   6.324  10.243  -2.654
  191    H4*    C  18           H4*        C  18   7.867   8.548  -1.701
  192    H3*    C  18           H3*        C  18   5.641   7.506  -3.491
  193    H2*    C  18           H2*        C  18   6.657   5.366  -3.353
  194   2HO*    C  18          2HO*        C  18   8.743   5.090  -2.446
  195    H1*    C  18           H1*        C  18   7.357   5.615  -0.644
  196   1H4     C  18          2H4         C  18   2.299   1.859  -0.734
  197   2H4     C  18          1H4         C  18   1.188   3.226  -0.806
  198    H5     C  18           H5         C  18   2.011   5.540  -1.185
  199    H6     C  18           H6         C  18   4.001   6.898  -1.403
  200    H3T    C  18           H3T        C  18   8.382   7.606  -4.048
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1   6.065  -8.410  -0.603
    2   2H5*    G   1          2H5*        G   1   6.433  -8.311   1.128
    3    H4*    G   1           H4*        G   1   7.922  -6.883  -0.247
    4    H3*    G   1           H3*        G   1   6.056  -5.367   1.605
    5    H2*    G   1           H2*        G   1   7.414  -3.442   1.045
    6   2HO*    G   1          2HO*        G   1   9.405  -4.761   1.029
    7    H1*    G   1           H1*        G   1   7.490  -4.060  -1.645
    8    H8     G   1           H8         G   1   3.953  -4.806  -0.663
    9    H1     G   1           H1         G   1   5.189   1.508  -0.763
   10   1H2     G   1          2H2         G   1   7.410   1.830  -0.814
   11   2H2     G   1          1H2         G   1   8.519   0.462  -0.924
   12    H5T    G   1           H5T        G   1   4.365  -6.917  -0.226
   13   1H5*    G   2          1H5*        G   2  10.171  -4.227   2.644
   14   2H5*    G   2          2H5*        G   2  10.255  -3.929   4.388
   15    H4*    G   2           H4*        G   2  10.975  -1.995   2.937
   16    H3*    G   2           H3*        G   2   8.674  -1.622   4.864
   17    H2*    G   2           H2*        G   2   8.711   0.714   4.252
   18   2HO*    G   2          2HO*        G   2  11.152   0.571   4.074
   19    H1*    G   2           H1*        G   2   8.968   0.274   1.578
   20    H8     G   2           H8         G   2   6.527  -2.364   2.728
   21    H1     G   2           H1         G   2   4.048   3.569   2.563
   22   1H2     G   2          2H2         G   2   5.752   5.071   2.614
   23   2H2     G   2          1H2         G   2   7.423   4.514   2.511
   24   1H5*    C   3          1H5*        C   3  11.311   1.760   5.522
   25   2H5*    C   3          2H5*        C   3  11.492   2.017   7.264
   26    H4*    C   3           H4*        C   3  10.644   4.033   6.008
   27    H3*    C   3           H3*        C   3   8.990   2.789   8.209
   28    H2*    C   3           H2*        C   3   7.360   4.426   7.877
   29   2HO*    C   3          2HO*        C   3   8.843   6.196   7.881
   30    H1*    C   3           H1*        C   3   7.733   4.777   5.118
   31   1H4     C   3          2H4         C   3   2.090   2.039   5.583
   32   2H4     C   3          1H4         C   3   2.816   0.436   5.605
   33    H5     C   3           H5         C   3   5.255   0.111   5.861
   34    H6     C   3           H6         C   3   7.383   1.257   5.937
   35   1H5*    U   4          1H5*        U   4   7.779   5.572  11.764
   36   2H5*    U   4          2H5*        U   4   7.346   4.326  10.592
   37    H4*    U   4           H4*        U   4   6.623   7.264  10.216
   38    H3*    U   4           H3*        U   4   5.208   5.045  11.694
   39    H2*    U   4           H2*        U   4   3.095   5.838  10.862
   40   2HO*    U   4          2HO*        U   4   3.964   8.127  10.984
   41    H1*    U   4           H1*        U   4   3.922   6.085   8.288
   42    H3     U   4           H3         U   4   1.349   2.258   8.757
   43    H5     U   4           H5         U   4   5.329   1.047   9.261
   44    H6     U   4           H6         U   4   5.999   3.357   9.298
   45   1H5*    A   5          1H5*        A   5   2.656   8.270  12.540
   46   2H5*    A   5          2H5*        A   5   2.300   8.287  14.277
   47    H4*    A   5           H4*        A   5   0.239   8.105  12.962
   48    H3*    A   5           H3*        A   5   0.958   5.591  14.500
   49    H2*    A   5           H2*        A   5  -1.221   4.783  13.887
   50   2HO*    A   5          2HO*        A   5  -2.306   6.853  14.113
   51    H1*    A   5           H1*        A   5  -0.965   5.520  11.259
   52    H8     A   5           H8         A   5   2.441   4.448  12.580
   53   1H6     A   5          1H6         A   5   0.585  -1.369  11.446
   54   2H6     A   5          2H6         A   5   1.989  -0.368  11.798
   55    H2     A   5           H2         A   5  -2.917   1.234  11.051
   56   1H5*    A   6          1H5*        A   6  -2.446   8.668  15.544
   57   2H5*    A   6          2H5*        A   6  -2.945   8.431  17.231
   58    H4*    A   6           H4*        A   6  -4.822   9.039  15.685
   59    H3*    A   6           H3*        A   6  -4.953   6.355  17.085
   60    H2*    A   6           H2*        A   6  -7.181   6.170  16.159
   61   2HO*    A   6          2HO*        A   6  -7.456   8.579  16.463
   62    H1*    A   6           H1*        A   6  -6.464   6.954  13.651
   63    H8     A   6           H8         A   6  -3.524   4.924  14.845
   64   1H6     A   6          1H6         A   6  -6.926  -0.052  13.336
   65   2H6     A   6          2H6         A   6  -5.312   0.473  13.807
   66    H2     A   6           H2         A   6  -9.613   3.432  13.402
   67   1H5*    G   7          1H5*        G   7  -8.670   7.048  17.888
   68   2H5*    G   7          2H5*        G   7  -9.036   6.677  19.584
   69    H4*    G   7           H4*        G   7 -10.190   5.153  18.003
   70    H3*    G   7           H3*        G   7  -8.109   3.876  19.794
   71    H2*    G   7           H2*        G   7  -8.860   1.751  18.890
   72   2HO*    G   7          2HO*        G   7 -11.133   2.654  18.759
   73    H1*    G   7           H1*        G   7  -8.819   2.575  16.303
   74    H8     G   7           H8         G   7  -5.898   4.377  17.898
   75    H1     G   7           H1         G   7  -4.832  -1.913  17.070
   76   1H2     G   7          2H2         G   7  -6.727  -2.929  16.512
   77   2H2     G   7          1H2         G   7  -8.218  -2.013  16.276
   78   1H5*    A   8          1H5*        A   8 -11.667   1.485  20.102
   79   2H5*    A   8          2H5*        A   8 -11.899   0.915  21.760
   80    H4*    A   8           H4*        A   8 -11.734  -0.906  20.026
   81    H3*    A   8           H3*        A   8  -9.715  -0.832  22.276
   82    H2*    A   8           H2*        A   8  -8.944  -2.984  21.454
   83   2HO*    A   8          2HO*        A   8 -11.266  -3.511  20.856
   84    H1*    A   8           H1*        A   8  -8.887  -2.214  18.833
   85    H8     A   8           H8         A   8  -7.730   0.895  20.598
   86   1H6     A   8          1H6         A   8  -2.146  -1.877  20.615
   87   2H6     A   8          2H6         A   8  -2.984  -0.339  20.786
   88    H2     A   8           H2         A   8  -5.197  -4.962  19.788
   89   1H5*    C   9          1H5*        C   9 -11.365  -4.817  22.293
   90   2H5*    C   9          2H5*        C   9 -11.690  -5.322  23.963
   91    H4*    C   9           H4*        C   9 -10.148  -6.887  22.792
   92    H3*    C   9           H3*        C   9  -8.963  -5.297  25.096
   93    H2*    C   9           H2*        C   9  -7.000  -6.621  24.869
   94   2HO*    C   9          2HO*        C   9  -6.958  -8.430  23.446
   95    H1*    C   9           H1*        C   9  -7.025  -6.556  22.082
   96   1H4     C   9          2H4         C   9  -2.823  -2.199  23.823
   97   2H4     C   9          1H4         C   9  -4.068  -0.964  24.016
   98    H5     C   9           H5         C   9  -6.479  -1.527  23.862
   99    H6     C   9           H6         C   9  -8.044  -3.308  23.423
  100    H3T    C   9           H3T        C   9  -9.531  -8.041  25.001
  101   1H5*    G  10          1H5*        G  10   7.173  -7.080  23.870
  102   2H5*    G  10          2H5*        G  10   7.159  -7.365  22.120
  103    H4*    G  10           H4*        G  10   5.507  -8.763  23.352
  104    H3*    G  10           H3*        G  10   4.388  -6.744  21.389
  105    H2*    G  10           H2*        G  10   2.253  -7.810  21.762
  106   2HO*    G  10          2HO*        G  10   3.351  -9.962  21.891
  107    H1*    G  10           H1*        G  10   2.567  -7.998  24.477
  108    H8     G  10           H8         G  10   3.901  -4.582  23.638
  109    H1     G  10           H1         G  10  -2.520  -4.938  23.438
  110   1H2     G  10          2H2         G  10  -3.133  -7.089  23.275
  111   2H2     G  10          1H2         G  10  -1.938  -8.384  23.386
  112    H5T    G  10           H5T        G  10   5.928  -5.218  23.508
  113   1H5*    U  11          1H5*        U  11   2.680 -10.581  20.206
  114   2H5*    U  11          2H5*        U  11   2.609 -10.626  18.437
  115    H4*    U  11           H4*        U  11   0.391 -10.945  19.522
  116    H3*    U  11           H3*        U  11   0.735  -8.473  17.805
  117    H2*    U  11           H2*        U  11  -1.654  -8.167  18.080
  118   2HO*    U  11          2HO*        U  11  -2.011 -10.538  17.999
  119    H1*    U  11           H1*        U  11  -1.639  -8.671  20.746
  120    H3     U  11           H3         U  11  -2.482  -4.229  20.283
  121    H5     U  11           H5         U  11   1.703  -4.543  20.069
  122    H6     U  11           H6         U  11   1.475  -6.942  19.941
  123   1H5*    C  12          1H5*        C  12  -2.822 -10.604  16.303
  124   2H5*    C  12          2H5*        C  12  -2.918 -10.367  14.551
  125    H4*    C  12           H4*        C  12  -4.934  -9.581  15.845
  126    H3*    C  12           H3*        C  12  -3.399  -7.576  14.175
  127    H2*    C  12           H2*        C  12  -5.151  -6.007  14.705
  128   2HO*    C  12          2HO*        C  12  -6.743  -7.877  14.562
  129    H1*    C  12           H1*        C  12  -5.369  -6.747  17.351
  130   1H4     C  12          2H4         C  12  -1.951  -1.514  17.481
  131   2H4     C  12          1H4         C  12  -0.426  -2.402  17.387
  132    H5     C  12           H5         C  12  -0.410  -4.854  16.886
  133    H6     C  12           H6         C  12  -1.828  -6.785  16.560
  134   1H5*    G  13          1H5*        G  13  -7.261  -6.503  13.063
  135   2H5*    G  13          2H5*        G  13  -7.293  -6.333  11.302
  136    H4*    G  13           H4*        G  13  -7.872  -4.225  12.377
  137    H3*    G  13           H3*        G  13  -5.197  -4.218  10.959
  138    H2*    G  13           H2*        G  13  -5.140  -1.850  11.346
  139   2HO*    G  13          2HO*        G  13  -7.484  -1.595  10.960
  140    H1*    G  13           H1*        G  13  -5.909  -2.031  13.973
  141    H8     G  13           H8         G  13  -3.760  -5.030  12.926
  142    H1     G  13           H1         G  13  -0.322   0.041  14.836
  143   1H2     G  13          1H2         G  13  -1.633   1.808  15.122
  144   2H2     G  13          2H2         G  13  -3.336   1.760  14.753
  145   1H5*    A  14          1H5*        A  14  -7.811  -0.886   7.064
  146   2H5*    A  14          2H5*        A  14  -6.736  -0.073   8.224
  147    H4*    A  14           H4*        A  14  -9.788  -0.197   8.331
  148    H3*    A  14           H3*        A  14  -7.820   1.941   7.532
  149    H2*    A  14           H2*        A  14  -9.050   3.620   8.648
  150   2HO*    A  14          2HO*        A  14 -11.204   2.688   8.111
  151    H1*    A  14           H1*        A  14  -9.338   2.317  10.955
  152    H8     A  14           H8         A  14  -6.253   0.614  10.321
  153   1H6     A  14          1H6         A  14  -3.280   5.867  11.749
  154   2H6     A  14          2H6         A  14  -3.094   4.132  11.493
  155    H2     A  14           H2         A  14  -7.476   6.894  10.780
  156   1H5*    A  15          1H5*        A  15  -8.509   4.474   4.403
  157   2H5*    A  15          2H5*        A  15  -7.553   3.720   5.705
  158    H4*    A  15           H4*        A  15  -8.778   6.518   5.837
  159    H3*    A  15           H3*        A  15  -6.031   5.589   4.987
  160    H2*    A  15           H2*        A  15  -5.101   7.555   6.031
  161   2HO*    A  15          2HO*        A  15  -7.164   8.763   5.385
  162    H1*    A  15           H1*        A  15  -6.452   7.265   8.361
  163    H8     A  15           H8         A  15  -6.146   3.699   7.635
  164   1H6     A  15          1H6         A  15  -0.020   4.203   8.681
  165   2H6     A  15          2H6         A  15  -1.315   3.030   8.362
  166    H2     A  15           H2         A  15  -1.707   8.223   8.705
  167   1H5*    G  16          1H5*        G  16  -5.660   9.580   4.222
  168   2H5*    G  16          2H5*        G  16  -5.033   9.857   2.589
  169    H4*    G  16           H4*        G  16  -3.615  10.856   4.383
  170    H3*    G  16           H3*        G  16  -2.435   8.704   2.619
  171    H2*    G  16           H2*        G  16  -0.319   9.110   3.709
  172   2HO*    G  16          2HO*        G  16  -0.937  11.490   3.819
  173    H1*    G  16           H1*        G  16  -1.337   9.195   6.240
  174    H8     G  16           H8         G  16  -3.409   6.481   4.732
  175    H1     G  16           H1         G  16   2.668   4.639   5.780
  176   1H2     G  16          2H2         G  16   3.976   6.457   5.957
  177   2H2     G  16          1H2         G  16   3.263   8.067   6.042
  178   1H5*    C  17          1H5*        C  17   0.452  11.841   2.473
  179   2H5*    C  17          2H5*        C  17   0.972  12.081   0.795
  180    H4*    C  17           H4*        C  17   2.865  11.539   2.309
  181    H3*    C  17           H3*        C  17   2.187   9.518   0.157
  182    H2*    C  17           H2*        C  17   4.196   8.352   0.803
  183   2HO*    C  17          2HO*        C  17   5.252  10.523   1.199
  184    H1*    C  17           H1*        C  17   3.765   8.633   3.504
  185   1H4     C  17          2H4         C  17   1.567   2.854   2.336
  186   2H4     C  17          1H4         C  17  -0.050   3.480   2.030
  187    H5     C  17           H5         C  17  -0.476   5.907   1.758
  188    H6     C  17           H6         C  17   0.524   8.096   1.941
  189   1H5*    C  18          1H5*        C  18   6.483  10.376  -0.307
  190   2H5*    C  18          2H5*        C  18   6.790  10.549  -2.046
  191    H4*    C  18           H4*        C  18   8.237   8.811  -1.022
  192    H3*    C  18           H3*        C  18   6.144   7.842  -3.006
  193    H2*    C  18           H2*        C  18   7.120   5.686  -2.843
  194   2HO*    C  18          2HO*        C  18   9.125   5.358  -1.782
  195    H1*    C  18           H1*        C  18   7.610   5.857  -0.083
  196   1H4     C  18          2H4         C  18   2.538   2.169  -0.650
  197   2H4     C  18          1H4         C  18   1.449   3.551  -0.746
  198    H5     C  18           H5         C  18   2.318   5.868  -0.983
  199    H6     C  18           H6         C  18   4.331   7.207  -1.023
  200    H3T    C  18           H3T        C  18   8.922   7.917  -3.345
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1   4.030  -8.352   0.709
    2   2H5*    G   1          2H5*        G   1   5.280  -8.481   1.955
    3    H4*    G   1           H4*        G   1   6.453  -7.670   0.115
    4    H3*    G   1           H3*        G   1   5.649  -5.240   1.753
    5    H2*    G   1           H2*        G   1   6.994  -3.937   0.326
    6   2HO*    G   1          2HO*        G   1   8.594  -5.734   0.105
    7    H1*    G   1           H1*        G   1   5.942  -5.012  -1.942
    8    H8     G   1           H8         G   1   2.827  -5.322  -0.139
    9    H1     G   1           H1         G   1   4.273   0.878  -1.041
   10   1H2     G   1          2H2         G   1   6.484   1.088  -1.340
   11   2H2     G   1          1H2         G   1   7.525  -0.332  -1.465
   12    H5T    G   1           H5T        G   1   4.545  -6.636   2.922
   13   1H5*    G   2          1H5*        G   2   9.589  -4.823   2.553
   14   2H5*    G   2          2H5*        G   2   9.836  -4.512   4.278
   15    H4*    G   2           H4*        G   2  10.496  -2.603   2.868
   16    H3*    G   2           H3*        G   2   8.097  -2.131   4.652
   17    H2*    G   2           H2*        G   2   8.227   0.174   3.954
   18   2HO*    G   2          2HO*        G   2  10.658   0.010   3.939
   19    H1*    G   2           H1*        G   2   8.603  -0.387   1.312
   20    H8     G   2           H8         G   2   6.109  -2.958   2.421
   21    H1     G   2           H1         G   2   3.673   3.001   2.264
   22   1H2     G   2          2H2         G   2   5.368   4.486   2.163
   23   2H2     G   2          1H2         G   2   7.029   3.927   1.970
   24   1H5*    C   3          1H5*        C   3  10.849   1.147   5.428
   25   2H5*    C   3          2H5*        C   3  10.896   1.449   7.173
   26    H4*    C   3           H4*        C   3  10.299   3.467   5.828
   27    H3*    C   3           H3*        C   3   8.215   2.408   7.760
   28    H2*    C   3           H2*        C   3   6.993   4.416   7.263
   29   2HO*    C   3          2HO*        C   3   9.091   5.641   7.138
   30    H1*    C   3           H1*        C   3   7.424   4.311   4.559
   31   1H4     C   3          2H4         C   3   1.707   1.752   5.500
   32   2H4     C   3          1H4         C   3   2.415   0.144   5.556
   33    H5     C   3           H5         C   3   4.848  -0.219   5.680
   34    H6     C   3           H6         C   3   6.994   0.876   5.586
   35   1H5*    U   4          1H5*        U   4   8.283   6.465   8.879
   36   2H5*    U   4          2H5*        U   4   8.117   6.595  10.639
   37    H4*    U   4           H4*        U   4   6.231   7.649   9.413
   38    H3*    U   4           H3*        U   4   5.435   5.160  10.924
   39    H2*    U   4           H2*        U   4   3.143   5.919  10.531
   40   2HO*    U   4          2HO*        U   4   4.065   8.335  10.185
   41    H1*    U   4           H1*        U   4   3.668   6.089   7.890
   42    H3     U   4           H3         U   4   1.328   2.216   8.755
   43    H5     U   4           H5         U   4   5.376   1.176   9.119
   44    H6     U   4           H6         U   4   5.955   3.508   8.979
   45   1H5*    A   5          1H5*        A   5   2.493   9.307  11.421
   46   2H5*    A   5          2H5*        A   5   2.304   9.626  13.155
   47    H4*    A   5           H4*        A   5   0.223   8.786  12.054
   48    H3*    A   5           H3*        A   5   1.454   6.968  14.140
   49    H2*    A   5           H2*        A   5  -0.536   5.609  13.900
   50   2HO*    A   5          2HO*        A   5  -2.013   7.411  13.692
   51    H1*    A   5           H1*        A   5  -0.541   5.746  11.138
   52    H8     A   5           H8         A   5   2.923   5.451  12.870
   53   1H6     A   5          1H6         A   5   2.014  -0.681  12.355
   54   2H6     A   5          2H6         A   5   3.200   0.551  12.785
   55    H2     A   5           H2         A   5  -1.654   1.321  11.004
   56   1H5*    A   6          1H5*        A   6  -2.178   7.217  17.932
   57   2H5*    A   6          2H5*        A   6  -2.717   5.816  17.008
   58    H4*    A   6           H4*        A   6  -3.236   8.752  16.365
   59    H3*    A   6           H3*        A   6  -4.853   6.402  17.312
   60    H2*    A   6           H2*        A   6  -6.686   6.858  15.914
   61   2HO*    A   6          2HO*        A   6  -6.179   9.269  16.231
   62    H1*    A   6           H1*        A   6  -5.272   7.196  13.649
   63    H8     A   6           H8         A   6  -2.782   4.925  14.891
   64   1H6     A   6          1H6         A   6  -6.657   0.246  13.681
   65   2H6     A   6          2H6         A   6  -4.990   0.666  14.046
   66    H2     A   6           H2         A   6  -9.048   3.964  13.790
   67   1H5*    G   7          1H5*        G   7  -7.715   7.601  18.391
   68   2H5*    G   7          2H5*        G   7  -8.134   7.199  20.069
   69    H4*    G   7           H4*        G   7  -9.210   5.713  18.376
   70    H3*    G   7           H3*        G   7  -7.203   4.348  20.198
   71    H2*    G   7           H2*        G   7  -8.051   2.286  19.217
   72   2HO*    G   7          2HO*        G   7 -10.274   3.267  19.078
   73    H1*    G   7           H1*        G   7  -7.928   3.242  16.664
   74    H8     G   7           H8         G   7  -4.897   4.667  18.446
   75    H1     G   7           H1         G   7  -4.373  -1.609  17.127
   76   1H2     G   7          2H2         G   7  -6.397  -2.437  16.660
   77   2H2     G   7          1H2         G   7  -7.798  -1.371  16.517
   78   1H5*    A   8          1H5*        A   8 -10.894   2.155  20.394
   79   2H5*    A   8          2H5*        A   8 -11.184   1.532  22.023
   80    H4*    A   8           H4*        A   8 -11.139  -0.209  20.196
   81    H3*    A   8           H3*        A   8  -9.188  -0.412  22.497
   82    H2*    A   8           H2*        A   8  -8.554  -2.582  21.574
   83   2HO*    A   8          2HO*        A   8 -10.926  -2.822  20.866
   84    H1*    A   8           H1*        A   8  -8.387  -1.690  18.997
   85    H8     A   8           H8         A   8  -7.006   1.273  20.800
   86   1H6     A   8          1H6         A   8  -1.630  -1.876  20.627
   87   2H6     A   8          2H6         A   8  -2.353  -0.281  20.780
   88    H2     A   8           H2         A   8  -4.928  -4.758  20.000
   89   1H5*    C   9          1H5*        C   9 -11.102  -4.105  22.236
   90   2H5*    C   9          2H5*        C   9 -11.689  -4.732  23.782
   91    H4*    C   9           H4*        C   9 -10.100  -6.260  22.539
   92    H3*    C   9           H3*        C   9 -10.223  -5.870  25.293
   93    H2*    C   9           H2*        C   9  -8.423  -4.324  25.374
   94   2HO*    C   9          2HO*        C   9  -6.523  -5.548  26.010
   95    H1*    C   9           H1*        C   9  -7.006  -6.064  23.325
   96   1H4     C   9          2H4         C   9  -2.671  -1.481  23.723
   97   2H4     C   9          1H4         C   9  -3.865  -0.182  23.789
   98    H5     C   9           H5         C   9  -6.300  -0.676  23.844
   99    H6     C   9           H6         C   9  -7.935  -2.456  23.726
  100    H3T    C   9           H3T        C   9  -8.482  -7.624  25.125
  101   1H5*    G  10          1H5*        G  10   6.734  -6.178  22.648
  102   2H5*    G  10          2H5*        G  10   6.748  -7.545  21.525
  103    H4*    G  10           H4*        G  10   5.459  -8.353  23.279
  104    H3*    G  10           H3*        G  10   3.497  -7.162  21.291
  105    H2*    G  10           H2*        G  10   1.749  -8.008  22.608
  106   2HO*    G  10          2HO*        G  10   3.058  -9.987  23.107
  107    H1*    G  10           H1*        G  10   2.833  -7.176  24.973
  108    H8     G  10           H8         G  10   3.918  -4.221  23.232
  109    H1     G  10           H1         G  10  -2.500  -4.356  23.658
  110   1H2     G  10          2H2         G  10  -3.180  -6.475  23.891
  111   2H2     G  10          1H2         G  10  -2.021  -7.789  24.104
  112    H5T    G  10           H5T        G  10   5.264  -6.548  20.240
  113   1H5*    U  11          1H5*        U  11   2.219 -10.926  20.620
  114   2H5*    U  11          2H5*        U  11   2.004 -11.223  18.887
  115    H4*    U  11           H4*        U  11  -0.142 -11.169  20.092
  116    H3*    U  11           H3*        U  11   0.313  -8.878  18.167
  117    H2*    U  11           H2*        U  11  -1.967  -8.230  18.631
  118   2HO*    U  11          2HO*        U  11  -2.600 -10.563  18.768
  119    H1*    U  11           H1*        U  11  -1.793  -8.568  21.317
  120    H3     U  11           H3         U  11  -2.086  -4.108  20.379
  121    H5     U  11           H5         U  11   2.017  -5.002  20.150
  122    H6     U  11           H6         U  11   1.464  -7.349  20.351
  123   1H5*    C  12          1H5*        C  12  -3.612 -10.561  17.220
  124   2H5*    C  12          2H5*        C  12  -3.807 -10.595  15.461
  125    H4*    C  12           H4*        C  12  -5.599  -9.309  16.705
  126    H3*    C  12           H3*        C  12  -3.912  -8.003  14.575
  127    H2*    C  12           H2*        C  12  -5.016  -5.974  14.927
  128   2HO*    C  12          2HO*        C  12  -7.131  -6.901  14.821
  129    H1*    C  12           H1*        C  12  -5.573  -6.307  17.657
  130   1H4     C  12          2H4         C  12  -1.514  -1.563  17.439
  131   2H4     C  12          1H4         C  12  -0.114  -2.637  17.485
  132    H5     C  12           H5         C  12  -0.397  -5.111  17.195
  133    H6     C  12           H6         C  12  -2.047  -6.879  17.039
  134   1H5*    G  13          1H5*        G  13  -5.842  -6.111  10.969
  135   2H5*    G  13          2H5*        G  13  -4.648  -6.055  12.265
  136    H4*    G  13           H4*        G  13  -7.194  -4.369  12.248
  137    H3*    G  13           H3*        G  13  -4.429  -3.879  11.132
  138    H2*    G  13           H2*        G  13  -4.559  -1.590  11.765
  139   2HO*    G  13          2HO*        G  13  -6.889  -1.414  11.249
  140    H1*    G  13           H1*        G  13  -5.424  -2.079  14.293
  141    H8     G  13           H8         G  13  -3.282  -5.040  13.382
  142    H1     G  13           H1         G  13   0.260   0.139  14.691
  143   1H2     G  13          1H2         G  13  -1.030   1.922  14.904
  144   2H2     G  13          2H2         G  13  -2.758   1.851  14.660
  145   1H5*    A  14          1H5*        A  14  -8.425  -2.056   9.385
  146   2H5*    A  14          2H5*        A  14  -8.122  -1.529   7.718
  147    H4*    A  14           H4*        A  14  -9.698  -0.050   8.971
  148    H3*    A  14           H3*        A  14  -7.067   1.208   8.218
  149    H2*    A  14           H2*        A  14  -8.133   3.327   8.773
  150   2HO*    A  14          2HO*        A  14 -10.451   2.276   8.374
  151    H1*    A  14           H1*        A  14  -8.762   2.335  11.219
  152    H8     A  14           H8         A  14  -5.651   0.401  10.642
  153   1H6     A  14          1H6         A  14  -2.622   5.734  11.753
  154   2H6     A  14          2H6         A  14  -2.387   3.996  11.558
  155    H2     A  14           H2         A  14  -6.812   6.704  10.924
  156   1H5*    A  15          1H5*        A  15  -8.638   3.930   4.449
  157   2H5*    A  15          2H5*        A  15  -7.509   3.388   5.705
  158    H4*    A  15           H4*        A  15  -9.128   5.976   5.810
  159    H3*    A  15           H3*        A  15  -6.310   5.328   4.934
  160    H2*    A  15           H2*        A  15  -5.520   7.369   5.914
  161   2HO*    A  15          2HO*        A  15  -7.680   8.397   5.277
  162    H1*    A  15           H1*        A  15  -6.802   7.044   8.282
  163    H8     A  15           H8         A  15  -6.209   3.497   7.556
  164   1H6     A  15          1H6         A  15  -0.163   4.414   8.623
  165   2H6     A  15          2H6         A  15  -1.403   3.188   8.318
  166    H2     A  15           H2         A  15  -2.126   8.351   8.573
  167   1H5*    G  16          1H5*        G  16  -6.038   9.199   4.032
  168   2H5*    G  16          2H5*        G  16  -5.505   9.409   2.354
  169    H4*    G  16           H4*        G  16  -3.959  10.460   3.974
  170    H3*    G  16           H3*        G  16  -2.895   8.132   2.361
  171    H2*    G  16           H2*        G  16  -0.734   8.602   3.331
  172   2HO*    G  16          2HO*        G  16  -1.301  10.991   3.256
  173    H1*    G  16           H1*        G  16  -1.659   8.910   5.879
  174    H8     G  16           H8         G  16  -3.817   6.128   4.625
  175    H1     G  16           H1         G  16   2.273   4.266   5.564
  176   1H2     G  16          2H2         G  16   3.609   6.070   5.572
  177   2H2     G  16          1H2         G  16   2.915   7.691   5.617
  178   1H5*    C  17          1H5*        C  17   0.019  11.214   1.850
  179   2H5*    C  17          2H5*        C  17   0.551  11.274   0.160
  180    H4*    C  17           H4*        C  17   2.408  10.874   1.786
  181    H3*    C  17           H3*        C  17   1.814   8.710  -0.247
  182    H2*    C  17           H2*        C  17   3.820   7.616   0.555
  183   2HO*    C  17          2HO*        C  17   4.778   9.879   0.912
  184    H1*    C  17           H1*        C  17   3.271   8.027   3.199
  185   1H4     C  17          2H4         C  17   1.110   2.208   2.321
  186   2H4     C  17          1H4         C  17  -0.522   2.814   2.049
  187    H5     C  17           H5         C  17  -0.949   5.226   1.621
  188    H6     C  17           H6         C  17   0.065   7.419   1.640
  189   1H5*    C  18          1H5*        C  18   5.996   9.528  -0.435
  190   2H5*    C  18          2H5*        C  18   6.555   9.710  -2.099
  191    H4*    C  18           H4*        C  18   7.803   8.006  -0.694
  192    H3*    C  18           H3*        C  18   7.228   7.882  -3.413
  193    H2*    C  18           H2*        C  18   5.344   6.459  -3.173
  194   2HO*    C  18          2HO*        C  18   6.120   4.266  -3.589
  195    H1*    C  18           H1*        C  18   6.903   4.949  -1.047
  196   1H4     C  18          2H4         C  18   1.539   1.641  -0.801
  197   2H4     C  18          1H4         C  18   0.499   3.065  -0.875
  198    H5     C  18           H5         C  18   1.469   5.348  -1.148
  199    H6     C  18           H6         C  18   3.548   6.581  -1.320
  200    H3T    C  18           H3T        C  18   8.598   5.846  -3.109
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1   7.441  -7.148   2.060
    2   2H5*    G   1          2H5*        G   1   8.530  -6.850   3.423
    3    H4*    G   1           H4*        G   1   9.670  -5.913   1.623
    4    H3*    G   1           H3*        G   1   8.104  -3.650   2.912
    5    H2*    G   1           H2*        G   1   9.234  -2.161   1.482
    6   2HO*    G   1          2HO*        G   1  11.247  -3.491   1.594
    7    H1*    G   1           H1*        G   1   8.741  -3.642  -0.745
    8    H8     G   1           H8         G   1   5.633  -4.616   0.839
    9    H1     G   1           H1         G   1   5.542   1.648  -0.612
   10   1H2     G   1          2H2         G   1   7.645   2.402  -0.778
   11   2H2     G   1          1H2         G   1   9.019   1.300  -0.670
   12    H5T    G   1           H5T        G   1   7.252  -5.187   4.115
   13   1H5*    G   2          1H5*        G   2  11.706  -2.176   4.046
   14   2H5*    G   2          2H5*        G   2  11.649  -1.665   5.740
   15    H4*    G   2           H4*        G   2  11.987   0.220   4.188
   16    H3*    G   2           H3*        G   2   9.344   0.213   5.662
   17    H2*    G   2           H2*        G   2   9.000   2.409   4.724
   18   2HO*    G   2          2HO*        G   2  11.385   2.859   4.955
   19    H1*    G   2           H1*        G   2   9.808   1.727   2.210
   20    H8     G   2           H8         G   2   7.910  -1.288   3.382
   21    H1     G   2           H1         G   2   4.117   3.823   2.397
   22   1H2     G   2          2H2         G   2   5.396   5.673   2.288
   23   2H2     G   2          1H2         G   2   7.155   5.543   2.270
   24   1H5*    C   3          1H5*        C   3  11.079   4.138   6.303
   25   2H5*    C   3          2H5*        C   3  10.860   4.592   8.001
   26    H4*    C   3           H4*        C   3   9.942   6.267   6.386
   27    H3*    C   3           H3*        C   3   8.000   4.901   8.271
   28    H2*    C   3           H2*        C   3   6.370   6.478   7.461
   29   2HO*    C   3          2HO*        C   3   8.116   8.172   7.345
   30    H1*    C   3           H1*        C   3   7.082   6.236   4.825
   31   1H4     C   3          2H4         C   3   2.098   2.328   5.565
   32   2H4     C   3          1H4         C   3   3.221   1.016   5.831
   33    H5     C   3           H5         C   3   5.609   1.303   6.148
   34    H6     C   3           H6         C   3   7.416   2.897   6.127
   35   1H5*    U   4          1H5*        U   4   6.654   8.674   8.921
   36   2H5*    U   4          2H5*        U   4   6.412   8.926  10.660
   37    H4*    U   4           H4*        U   4   4.280   9.074   9.425
   38    H3*    U   4           H3*        U   4   4.516   6.556  11.082
   39    H2*    U   4           H2*        U   4   2.162   6.272  10.731
   40   2HO*    U   4          2HO*        U   4   1.539   8.543  10.620
   41    H1*    U   4           H1*        U   4   2.480   6.656   8.053
   42    H3     U   4           H3         U   4   1.789   2.183   8.941
   43    H5     U   4           H5         U   4   5.919   2.761   9.418
   44    H6     U   4           H6         U   4   5.580   5.136   9.177
   45   1H5*    A   5          1H5*        A   5   0.993   8.806  14.287
   46   2H5*    A   5          2H5*        A   5   1.845   7.436  13.546
   47    H4*    A   5           H4*        A   5  -0.951   8.380  12.761
   48    H3*    A   5           H3*        A   5   0.049   6.097  14.490
   49    H2*    A   5           H2*        A   5  -1.838   4.810  13.757
   50   2HO*    A   5          2HO*        A   5  -3.366   6.580  13.739
   51    H1*    A   5           H1*        A   5  -1.494   5.446  11.113
   52    H8     A   5           H8         A   5   1.914   5.262  12.828
   53   1H6     A   5          1H6         A   5   1.658  -0.833  11.636
   54   2H6     A   5          2H6         A   5   2.732   0.474  12.123
   55    H2     A   5           H2         A   5  -2.289   0.858  10.744
   56   1H5*    A   6          1H5*        A   6  -4.003   8.377  14.947
   57   2H5*    A   6          2H5*        A   6  -4.591   8.186  16.611
   58    H4*    A   6           H4*        A   6  -6.406   8.218  14.880
   59    H3*    A   6           H3*        A   6  -6.077   5.715  16.555
   60    H2*    A   6           H2*        A   6  -8.114   4.948  15.516
   61   2HO*    A   6          2HO*        A   6  -8.934   7.256  15.577
   62    H1*    A   6           H1*        A   6  -7.415   5.733  12.982
   63    H8     A   6           H8         A   6  -4.234   4.359  14.442
   64   1H6     A   6          1H6         A   6  -6.626  -1.251  13.145
   65   2H6     A   6          2H6         A   6  -5.145  -0.434  13.635
   66    H2     A   6           H2         A   6  -9.860   1.691  12.820
   67   1H5*    G   7          1H5*        G   7 -10.020   5.790  17.077
   68   2H5*    G   7          2H5*        G   7 -10.405   5.492  18.783
   69    H4*    G   7           H4*        G   7 -11.223   3.676  17.333
   70    H3*    G   7           H3*        G   7  -8.976   2.901  19.211
   71    H2*    G   7           H2*        G   7  -9.327   0.621  18.442
   72   2HO*    G   7          2HO*        G   7 -11.721   1.112  18.220
   73    H1*    G   7           H1*        G   7  -9.347   1.273  15.814
   74    H8     G   7           H8         G   7  -6.883   3.718  17.313
   75    H1     G   7           H1         G   7  -4.578  -2.273  16.985
   76   1H2     G   7          2H2         G   7  -6.241  -3.694  16.580
   77   2H2     G   7          1H2         G   7  -7.879  -3.116  16.263
   78   1H5*    A   8          1H5*        A   8 -11.980  -0.091  19.641
   79   2H5*    A   8          2H5*        A   8 -12.173  -0.562  21.334
   80    H4*    A   8           H4*        A   8 -11.601  -2.445  19.756
   81    H3*    A   8           H3*        A   8  -9.774  -1.835  22.086
   82    H2*    A   8           H2*        A   8  -8.540  -3.847  21.469
   83   2HO*    A   8          2HO*        A   8 -10.730  -4.802  20.771
   84    H1*    A   8           H1*        A   8  -8.491  -3.283  18.798
   85    H8     A   8           H8         A   8  -8.044   0.159  20.142
   86   1H6     A   8          1H6         A   8  -2.020  -1.387  20.490
   87   2H6     A   8          2H6         A   8  -3.159  -0.052  20.389
   88    H2     A   8           H2         A   8  -4.385  -5.128  20.298
   89   1H5*    C   9          1H5*        C   9 -10.619  -5.908  22.307
   90   2H5*    C   9          2H5*        C   9 -11.103  -6.461  23.916
   91    H4*    C   9           H4*        C   9  -9.097  -7.651  22.941
   92    H3*    C   9           H3*        C   9  -9.465  -6.927  25.605
   93    H2*    C   9           H2*        C   9  -8.156  -4.950  25.475
   94   2HO*    C   9          2HO*        C   9  -6.045  -5.491  26.324
   95    H1*    C   9           H1*        C   9  -6.216  -6.506  23.729
   96   1H4     C   9          2H4         C   9  -3.299  -0.901  23.491
   97   2H4     C   9          1H4         C   9  -4.801   0.020  23.377
   98    H5     C   9           H5         C   9  -7.012  -1.109  23.484
   99    H6     C   9           H6         C   9  -8.101  -3.267  23.599
  100    H3T    C   9           H3T        C   9  -7.309  -8.140  25.724
  101   1H5*    G  10          1H5*        G  10   7.038  -2.736  23.299
  102   2H5*    G  10          2H5*        G  10   7.539  -4.077  22.259
  103    H4*    G  10           H4*        G  10   6.442  -5.169  23.989
  104    H3*    G  10           H3*        G  10   4.354  -4.723  21.830
  105    H2*    G  10           H2*        G  10   2.847  -5.993  23.109
  106   2HO*    G  10          2HO*        G  10   4.641  -7.459  23.815
  107    H1*    G  10           H1*        G  10   3.436  -4.743  25.452
  108    H8     G  10           H8         G  10   3.800  -1.733  23.464
  109    H1     G  10           H1         G  10  -2.349  -3.612  23.734
  110   1H2     G  10          2H2         G  10  -2.434  -5.805  24.175
  111   2H2     G  10          1H2         G  10  -0.968  -6.727  24.516
  112    H5T    G  10           H5T        G  10   5.916  -3.632  20.844
  113   1H5*    U  11          1H5*        U  11   4.409  -8.762  21.292
  114   2H5*    U  11          2H5*        U  11   4.385  -9.159  19.566
  115    H4*    U  11           H4*        U  11   2.275  -9.751  20.690
  116    H3*    U  11           H3*        U  11   2.065  -7.487  18.690
  117    H2*    U  11           H2*        U  11  -0.325  -7.629  19.037
  118   2HO*    U  11          2HO*        U  11  -0.185 -10.022  19.248
  119    H1*    U  11           H1*        U  11  -0.174  -7.777  21.737
  120    H3     U  11           H3         U  11  -1.840  -3.700  20.470
  121    H5     U  11           H5         U  11   2.337  -3.232  20.416
  122    H6     U  11           H6         U  11   2.559  -5.612  20.791
  123   1H5*    C  12          1H5*        C  12  -0.999 -10.423  17.609
  124   2H5*    C  12          2H5*        C  12  -1.163 -10.465  15.847
  125    H4*    C  12           H4*        C  12  -3.274  -9.895  17.116
  126    H3*    C  12           H3*        C  12  -2.188  -7.938  15.079
  127    H2*    C  12           H2*        C  12  -4.183  -6.643  15.453
  128   2HO*    C  12          2HO*        C  12  -5.406  -8.766  15.684
  129    H1*    C  12           H1*        C  12  -4.205  -6.961  18.188
  130   1H4     C  12          2H4         C  12  -1.805  -1.266  17.280
  131   2H4     C  12          1H4         C  12  -0.143  -1.863  17.342
  132    H5     C  12           H5         C  12   0.322  -4.327  17.280
  133    H6     C  12           H6         C  12  -0.725  -6.505  17.349
  134   1H5*    G  13          1H5*        G  13  -6.164  -7.652  14.007
  135   2H5*    G  13          2H5*        G  13  -6.259  -7.789  12.245
  136    H4*    G  13           H4*        G  13  -7.099  -5.621  12.968
  137    H3*    G  13           H3*        G  13  -4.468  -5.525  11.480
  138    H2*    G  13           H2*        G  13  -4.666  -3.146  11.470
  139   2HO*    G  13          2HO*        G  13  -6.995  -3.154  11.075
  140    H1*    G  13           H1*        G  13  -5.427  -2.958  14.108
  141    H8     G  13           H8         G  13  -2.897  -5.777  13.493
  142    H1     G  13           H1         G  13  -0.182  -0.021  14.329
  143   1H2     G  13          1H2         G  13  -1.742   1.556  14.462
  144   2H2     G  13          2H2         G  13  -3.438   1.199  14.278
  145   1H5*    A  14          1H5*        A  14  -6.868  -2.935   7.159
  146   2H5*    A  14          2H5*        A  14  -5.944  -2.051   8.397
  147    H4*    A  14           H4*        A  14  -8.992  -2.123   8.159
  148    H3*    A  14           H3*        A  14  -6.901  -0.122   7.288
  149    H2*    A  14           H2*        A  14  -8.359   1.676   7.921
  150   2HO*    A  14          2HO*        A  14 -10.253   0.276   7.191
  151    H1*    A  14           H1*        A  14  -9.020   0.641  10.347
  152    H8     A  14           H8         A  14  -5.551  -0.615  10.250
  153   1H6     A  14          1H6         A  14  -3.757   5.242  11.345
  154   2H6     A  14          2H6         A  14  -3.190   3.574  11.242
  155    H2     A  14           H2         A  14  -7.963   5.333  10.042
  156   1H5*    A  15          1H5*        A  15  -9.823   2.136   5.768
  157   2H5*    A  15          2H5*        A  15  -9.454   2.472   4.066
  158    H4*    A  15           H4*        A  15  -9.598   4.547   5.354
  159    H3*    A  15           H3*        A  15  -6.845   3.830   4.326
  160    H2*    A  15           H2*        A  15  -6.090   5.961   5.166
  161   2HO*    A  15          2HO*        A  15  -8.280   6.892   4.542
  162    H1*    A  15           H1*        A  15  -7.333   5.761   7.577
  163    H8     A  15           H8         A  15  -6.329   2.237   6.932
  164   1H6     A  15          1H6         A  15  -0.545   3.938   8.454
  165   2H6     A  15          2H6         A  15  -1.581   2.550   8.088
  166    H2     A  15           H2         A  15  -2.964   7.585   8.098
  167   1H5*    G  16          1H5*        G  16  -7.054   7.872   3.228
  168   2H5*    G  16          2H5*        G  16  -6.463   8.047   1.567
  169    H4*    G  16           H4*        G  16  -5.151   9.373   3.204
  170    H3*    G  16           H3*        G  16  -3.712   7.137   1.761
  171    H2*    G  16           H2*        G  16  -1.681   7.974   2.782
  172   2HO*    G  16          2HO*        G  16  -2.525  10.243   2.558
  173    H1*    G  16           H1*        G  16  -2.761   8.248   5.268
  174    H8     G  16           H8         G  16  -4.384   5.121   3.922
  175    H1     G  16           H1         G  16   1.753   4.262   5.652
  176   1H2     G  16          1H2         G  16   2.779   6.046   5.671
  177   2H2     G  16          2H2         G  16   2.148   7.608   5.442
  178   1H5*    C  17          1H5*        C  17  -1.403  10.790   1.188
  179   2H5*    C  17          2H5*        C  17  -0.759  10.845  -0.461
  180    H4*    C  17           H4*        C  17   0.990  11.008   1.331
  181    H3*    C  17           H3*        C  17   1.095   8.655  -0.573
  182    H2*    C  17           H2*        C  17   3.230   8.128   0.442
  183   2HO*    C  17          2HO*        C  17   3.590  10.571   0.690
  184    H1*    C  17           H1*        C  17   2.375   8.548   3.008
  185   1H4     C  17          2H4         C  17   1.781   2.339   2.434
  186   2H4     C  17          1H4         C  17   0.073   2.495   2.026
  187    H5     C  17           H5         C  17  -0.892   4.701   1.372
  188    H6     C  17           H6         C  17  -0.441   7.073   1.274
  189   1H5*    C  18          1H5*        C  18   4.974  10.456  -0.539
  190   2H5*    C  18          2H5*        C  18   5.574  10.716  -2.179
  191    H4*    C  18           H4*        C  18   7.132   9.450  -0.638
  192    H3*    C  18           H3*        C  18   6.755   9.059  -3.366
  193    H2*    C  18           H2*        C  18   5.282   7.213  -3.120
  194   2HO*    C  18          2HO*        C  18   6.603   5.278  -3.388
  195    H1*    C  18           H1*        C  18   7.062   6.254  -0.853
  196   1H4     C  18          2H4         C  18   2.703   1.704  -0.553
  197   2H4     C  18          1H4         C  18   1.343   2.810  -0.756
  198    H5     C  18           H5         C  18   1.717   5.242  -1.170
  199    H6     C  18           H6         C  18   3.423   6.953  -1.359
  200    H3T    C  18           H3T        C  18   8.578   7.459  -2.893
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1   3.878  -9.159  -0.176
    2   2H5*    G   1          2H5*        G   1   4.562  -9.190   1.457
    3    H4*    G   1           H4*        G   1   6.207  -8.231   0.003
    4    H3*    G   1           H3*        G   1   4.828  -6.085   1.642
    5    H2*    G   1           H2*        G   1   6.478  -4.566   0.800
    6   2HO*    G   1          2HO*        G   1   8.166  -6.287   0.849
    7    H1*    G   1           H1*        G   1   6.184  -5.389  -1.784
    8    H8     G   1           H8         G   1   2.696  -5.771  -0.519
    9    H1     G   1           H1         G   1   4.375   0.407  -1.183
   10   1H2     G   1          2H2         G   1   6.602   0.556  -1.393
   11   2H2     G   1          1H2         G   1   7.609  -0.892  -1.431
   12    H5T    G   1           H5T        G   1   3.306  -7.422   2.001
   13   1H5*    G   2          1H5*        G   2   8.891  -5.525   2.582
   14   2H5*    G   2          2H5*        G   2   9.059  -5.159   4.308
   15    H4*    G   2           H4*        G   2   9.985  -3.389   2.822
   16    H3*    G   2           H3*        G   2   7.642  -2.630   4.582
   17    H2*    G   2           H2*        G   2   8.012  -0.359   3.837
   18   2HO*    G   2          2HO*        G   2  10.409  -0.773   3.807
   19    H1*    G   2           H1*        G   2   8.282  -1.016   1.210
   20    H8     G   2           H8         G   2   5.575  -3.321   2.498
   21    H1     G   2           H1         G   2   3.685   2.809   1.976
   22   1H2     G   2          2H2         G   2   5.513   4.129   1.805
   23   2H2     G   2          1H2         G   2   7.118   3.410   1.658
   24   1H5*    C   3          1H5*        C   3  10.713   0.375   5.277
   25   2H5*    C   3          2H5*        C   3  10.763   0.764   7.004
   26    H4*    C   3           H4*        C   3  10.375   2.748   5.519
   27    H3*    C   3           H3*        C   3   8.209   2.024   7.515
   28    H2*    C   3           H2*        C   3   7.172   4.107   6.879
   29   2HO*    C   3          2HO*        C   3   9.388   5.103   6.675
   30    H1*    C   3           H1*        C   3   7.595   3.778   4.192
   31   1H4     C   3          2H4         C   3   1.614   1.823   5.211
   32   2H4     C   3          1H4         C   3   2.219   0.193   5.375
   33    H5     C   3           H5         C   3   4.569  -0.382   5.567
   34    H6     C   3           H6         C   3   6.816   0.479   5.449
   35   1H5*    U   4          1H5*        U   4   8.191   5.977   8.328
   36   2H5*    U   4          2H5*        U   4   8.175   6.218  10.084
   37    H4*    U   4           H4*        U   4   6.115   7.090   9.054
   38    H3*    U   4           H3*        U   4   5.666   4.543  10.619
   39    H2*    U   4           H2*        U   4   3.325   5.034  10.493
   40   2HO*    U   4          2HO*        U   4   3.462   7.390  10.514
   41    H1*    U   4           H1*        U   4   3.526   5.454   7.804
   42    H3     U   4           H3         U   4   1.522   1.381   8.634
   43    H5     U   4           H5         U   4   5.642   0.607   8.808
   44    H6     U   4           H6         U   4   6.062   2.973   8.605
   45   1H5*    A   5          1H5*        A   5   3.473   7.529  14.254
   46   2H5*    A   5          2H5*        A   5   3.654   6.035  13.313
   47    H4*    A   5           H4*        A   5   1.309   7.976  13.081
   48    H3*    A   5           H3*        A   5   1.654   5.294  14.462
   49    H2*    A   5           H2*        A   5  -0.676   4.888  14.047
   50   2HO*    A   5          2HO*        A   5  -1.362   7.106  14.422
   51    H1*    A   5           H1*        A   5  -0.524   5.665  11.420
   52    H8     A   5           H8         A   5   2.771   4.047  12.439
   53   1H6     A   5          1H6         A   5   0.089  -1.277  10.683
   54   2H6     A   5          2H6         A   5   1.640  -0.524  11.034
   55    H2     A   5           H2         A   5  -3.061   1.743  11.004
   56   1H5*    A   6          1H5*        A   6  -1.095   8.809  15.962
   57   2H5*    A   6          2H5*        A   6  -1.429   8.564  17.689
   58    H4*    A   6           H4*        A   6  -3.361   9.513  16.415
   59    H3*    A   6           H3*        A   6  -3.720   6.794  17.699
   60    H2*    A   6           H2*        A   6  -6.045   6.972  17.049
   61   2HO*    A   6          2HO*        A   6  -5.935   9.372  17.483
   62    H1*    A   6           H1*        A   6  -5.516   7.784  14.504
   63    H8     A   6           H8         A   6  -2.750   5.344  15.242
   64   1H6     A   6          1H6         A   6  -6.903   0.896  14.025
   65   2H6     A   6          2H6         A   6  -5.190   1.216  14.280
   66    H2     A   6           H2         A   6  -9.111   4.674  14.568
   67   1H5*    G   7          1H5*        G   7  -7.119   7.851  19.074
   68   2H5*    G   7          2H5*        G   7  -7.290   7.410  20.785
   69    H4*    G   7           H4*        G   7  -8.808   6.118  19.308
   70    H3*    G   7           H3*        G   7  -6.654   4.504  20.700
   71    H2*    G   7           H2*        G   7  -7.777   2.545  19.796
   72   2HO*    G   7          2HO*        G   7  -9.922   3.702  20.036
   73    H1*    G   7           H1*        G   7  -7.970   3.545  17.284
   74    H8     G   7           H8         G   7  -4.683   4.917  18.559
   75    H1     G   7           H1         G   7  -4.451  -1.379  17.263
   76   1H2     G   7          2H2         G   7  -6.512  -2.155  16.949
   77   2H2     G   7          1H2         G   7  -7.908  -1.074  16.974
   78   1H5*    A   8          1H5*        A   8 -10.397   2.511  21.359
   79   2H5*    A   8          2H5*        A   8 -10.488   1.830  22.987
   80    H4*    A   8           H4*        A   8 -10.787   0.181  21.087
   81    H3*    A   8           H3*        A   8  -8.601  -0.235  23.131
   82    H2*    A   8           H2*        A   8  -8.191  -2.385  22.051
   83   2HO*    A   8          2HO*        A   8 -10.641  -2.469  21.614
   84    H1*    A   8           H1*        A   8  -8.268  -1.392  19.511
   85    H8     A   8           H8         A   8  -6.545   1.434  21.220
   86   1H6     A   8          1H6         A   8  -1.381  -1.940  20.361
   87   2H6     A   8          2H6         A   8  -2.015  -0.326  20.643
   88    H2     A   8           H2         A   8  -4.866  -4.656  20.008
   89   1H5*    C   9          1H5*        C   9 -10.744  -3.813  22.940
   90   2H5*    C   9          2H5*        C   9 -11.188  -4.479  24.518
   91    H4*    C   9           H4*        C   9  -9.837  -6.030  23.047
   92    H3*    C   9           H3*        C   9  -9.618  -5.751  25.808
   93    H2*    C   9           H2*        C   9  -7.747  -4.291  25.733
   94   2HO*    C   9          2HO*        C   9  -5.857  -5.612  26.119
   95    H1*    C   9           H1*        C   9  -6.660  -6.011  23.476
   96   1H4     C   9          2H4         C   9  -2.086  -1.644  23.563
   97   2H4     C   9          1H4         C   9  -3.197  -0.300  23.842
   98    H5     C   9           H5         C   9  -5.631  -0.690  24.154
   99    H6     C   9           H6         C   9  -7.356  -2.385  24.137
  100    H3T    C   9           H3T        C   9  -7.999  -7.574  25.377
  101   1H5*    G  10          1H5*        G  10   6.991  -6.498  21.594
  102   2H5*    G  10          2H5*        G  10   6.930  -7.707  20.304
  103    H4*    G  10           H4*        G  10   5.701  -8.717  21.993
  104    H3*    G  10           H3*        G  10   3.683  -7.257  20.255
  105    H2*    G  10           H2*        G  10   1.968  -8.220  21.537
  106   2HO*    G  10          2HO*        G  10   3.243 -10.269  21.751
  107    H1*    G  10           H1*        G  10   3.140  -7.669  23.929
  108    H8     G  10           H8         G  10   4.301  -4.604  22.384
  109    H1     G  10           H1         G  10  -2.076  -4.506  23.239
  110   1H2     G  10          2H2         G  10  -2.840  -6.608  23.352
  111   2H2     G  10          1H2         G  10  -1.735  -7.985  23.330
  112    H5T    G  10           H5T        G  10   5.417  -6.531  19.225
  113   1H5*    U  11          1H5*        U  11   2.340 -10.924  19.149
  114   2H5*    U  11          2H5*        U  11   2.057 -10.982  17.402
  115    H4*    U  11           H4*        U  11  -0.040 -11.086  18.682
  116    H3*    U  11           H3*        U  11   0.352  -8.536  17.097
  117    H2*    U  11           H2*        U  11  -1.921  -7.998  17.722
  118   2HO*    U  11          2HO*        U  11  -2.565 -10.302  17.537
  119    H1*    U  11           H1*        U  11  -1.632  -8.692  20.323
  120    H3     U  11           H3         U  11  -1.977  -4.140  19.953
  121    H5     U  11           H5         U  11   2.110  -4.966  19.411
  122    H6     U  11           H6         U  11   1.580  -7.327  19.379
  123   1H5*    C  12          1H5*        C  12  -3.569 -10.179  15.968
  124   2H5*    C  12          2H5*        C  12  -3.862  -9.829  14.258
  125    H4*    C  12           H4*        C  12  -5.598  -8.920  15.849
  126    H3*    C  12           H3*        C  12  -4.084  -6.997  14.068
  127    H2*    C  12           H2*        C  12  -5.565  -5.283  14.893
  128   2HO*    C  12          2HO*        C  12  -7.360  -6.967  14.902
  129    H1*    C  12           H1*        C  12  -5.504  -6.128  17.515
  130   1H4     C  12          2H4         C  12  -1.516  -1.308  17.264
  131   2H4     C  12          1H4         C  12  -0.129  -2.359  16.953
  132    H5     C  12           H5         C  12  -0.464  -4.783  16.425
  133    H6     C  12           H6         C  12  -2.124  -6.534  16.283
  134   1H5*    G  13          1H5*        G  13  -7.906  -5.471  13.534
  135   2H5*    G  13          2H5*        G  13  -8.159  -5.211  11.803
  136    H4*    G  13           H4*        G  13  -8.353  -3.113  13.027
  137    H3*    G  13           H3*        G  13  -5.917  -3.305  11.239
  138    H2*    G  13           H2*        G  13  -5.556  -0.976  11.698
  139   2HO*    G  13          2HO*        G  13  -7.893  -0.475  11.667
  140    H1*    G  13           H1*        G  13  -5.959  -1.216  14.400
  141    H8     G  13           H8         G  13  -4.317  -4.368  12.971
  142    H1     G  13           H1         G  13  -0.115   0.240  14.486
  143   1H2     G  13          1H2         G  13  -1.176   2.110  15.037
  144   2H2     G  13          2H2         G  13  -2.910   2.250  14.918
  145   1H5*    A  14          1H5*        A  14  -8.623   0.500   7.886
  146   2H5*    A  14          2H5*        A  14  -7.323   1.106   8.939
  147    H4*    A  14           H4*        A  14 -10.331   1.326   9.436
  148    H3*    A  14           H3*        A  14  -8.233   3.264   8.482
  149    H2*    A  14           H2*        A  14  -9.063   4.999   9.844
  150   2HO*    A  14          2HO*        A  14 -11.366   4.421   9.567
  151    H1*    A  14           H1*        A  14  -9.221   3.593  12.104
  152    H8     A  14           H8         A  14  -6.507   1.559  11.021
  153   1H6     A  14          1H6         A  14  -2.685   6.324  12.101
  154   2H6     A  14          2H6         A  14  -2.771   4.586  11.803
  155    H2     A  14           H2         A  14  -6.789   7.927  11.704
  156   1H5*    A  15          1H5*        A  15  -8.872   5.967   5.565
  157   2H5*    A  15          2H5*        A  15  -7.897   4.997   6.695
  158    H4*    A  15           H4*        A  15  -8.553   7.960   7.061
  159    H3*    A  15           H3*        A  15  -6.214   6.577   5.750
  160    H2*    A  15           H2*        A  15  -4.734   8.236   6.665
  161   2HO*    A  15          2HO*        A  15  -6.570   9.876   6.384
  162    H1*    A  15           H1*        A  15  -5.731   8.131   9.186
  163    H8     A  15           H8         A  15  -6.329   4.625   8.411
  164   1H6     A  15          1H6         A  15  -0.160   3.723   8.436
  165   2H6     A  15          2H6         A  15  -1.715   2.886   8.295
  166    H2     A  15           H2         A  15  -0.883   8.021   8.750
  167   1H5*    G  16          1H5*        G  16  -5.149  10.414   4.912
  168   2H5*    G  16          2H5*        G  16  -4.796  10.596   3.185
  169    H4*    G  16           H4*        G  16  -2.864  11.198   4.612
  170    H3*    G  16           H3*        G  16  -2.558   8.780   2.820
  171    H2*    G  16           H2*        G  16  -0.235   8.730   3.490
  172   2HO*    G  16          2HO*        G  16  -0.234  11.167   3.553
  173    H1*    G  16           H1*        G  16  -0.751   9.065   6.146
  174    H8     G  16           H8         G  16  -3.617   6.906   5.042
  175    H1     G  16           H1         G  16   1.979   3.738   5.319
  176   1H2     G  16          1H2         G  16   3.579   5.039   5.270
  177   2H2     G  16          2H2         G  16   3.534   6.739   5.301
  178   1H5*    C  17          1H5*        C  17   0.846  11.379   2.033
  179   2H5*    C  17          2H5*        C  17   1.116  11.452   0.284
  180    H4*    C  17           H4*        C  17   3.138  10.749   1.561
  181    H3*    C  17           H3*        C  17   1.925   8.753  -0.368
  182    H2*    C  17           H2*        C  17   3.882   7.398   0.032
  183   2HO*    C  17          2HO*        C  17   5.199   9.460   0.172
  184    H1*    C  17           H1*        C  17   3.888   7.823   2.754
  185   1H4     C  17          2H4         C  17   1.048   2.247   2.098
  186   2H4     C  17          1H4         C  17  -0.544   3.002   2.049
  187    H5     C  17           H5         C  17  -0.797   5.465   1.788
  188    H6     C  17           H6         C  17   0.409   7.558   1.745
  189   1H5*    C  18          1H5*        C  18   6.209   9.121  -1.423
  190   2H5*    C  18          2H5*        C  18   6.280   9.253  -3.189
  191    H4*    C  18           H4*        C  18   7.717   7.422  -2.418
  192    H3*    C  18           H3*        C  18   5.199   6.491  -3.859
  193    H2*    C  18           H2*        C  18   6.167   4.313  -3.840
  194   2HO*    C  18          2HO*        C  18   8.355   5.315  -4.241
  195    H1*    C  18           H1*        C  18   7.108   4.548  -1.228
  196   1H4     C  18          2H4         C  18   1.729   1.268  -0.821
  197   2H4     C  18          1H4         C  18   0.731   2.721  -0.874
  198    H5     C  18           H5         C  18   1.729   4.949  -1.365
  199    H6     C  18           H6         C  18   3.812   6.118  -1.739
  200    H3T    C  18           H3T        C  18   6.578   7.771  -5.123
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1   5.357  -8.341   2.153
    2   2H5*    G   1          2H5*        G   1   6.529  -8.253   3.476
    3    H4*    G   1           H4*        G   1   7.758  -7.540   1.631
    4    H3*    G   1           H3*        G   1   6.691  -5.029   2.972
    5    H2*    G   1           H2*        G   1   8.022  -3.771   1.492
    6   2HO*    G   1          2HO*        G   1   9.758  -5.450   1.536
    7    H1*    G   1           H1*        G   1   7.182  -5.129  -0.709
    8    H8     G   1           H8         G   1   4.013  -5.501   1.024
    9    H1     G   1           H1         G   1   5.027   0.651  -0.550
   10   1H2     G   1          2H2         G   1   7.224   0.995  -0.824
   11   2H2     G   1          1H2         G   1   8.373  -0.342  -0.744
   12    H5T    G   1           H5T        G   1   5.606  -6.388   4.208
   13   1H5*    G   2          1H5*        G   2  10.568  -4.303   4.024
   14   2H5*    G   2          2H5*        G   2  10.643  -3.765   5.710
   15    H4*    G   2           H4*        G   2  11.299  -2.007   4.105
   16    H3*    G   2           H3*        G   2   8.749  -1.476   5.646
   17    H2*    G   2           H2*        G   2   8.816   0.731   4.668
   18   2HO*    G   2          2HO*        G   2  11.244   0.714   4.832
   19    H1*    G   2           H1*        G   2   9.401  -0.141   2.150
   20    H8     G   2           H8         G   2   6.977  -2.697   3.451
   21    H1     G   2           H1         G   2   4.249   3.049   2.446
   22   1H2     G   2          2H2         G   2   5.870   4.599   2.217
   23   2H2     G   2          1H2         G   2   7.564   4.114   2.140
   24   1H5*    C   3          1H5*        C   3  11.270   2.020   6.181
   25   2H5*    C   3          2H5*        C   3  11.165   2.569   7.862
   26    H4*    C   3           H4*        C   3  10.579   4.326   6.163
   27    H3*    C   3           H3*        C   3   8.454   3.483   8.155
   28    H2*    C   3           H2*        C   3   7.149   5.310   7.276
   29   2HO*    C   3          2HO*        C   3   9.210   6.597   7.028
   30    H1*    C   3           H1*        C   3   7.723   4.788   4.654
   31   1H4     C   3          2H4         C   3   2.071   2.053   5.724
   32   2H4     C   3          1H4         C   3   2.908   0.542   5.980
   33    H5     C   3           H5         C   3   5.312   0.336   6.249
   34    H6     C   3           H6         C   3   7.409   1.517   6.111
   35   1H5*    U   4          1H5*        U   4   7.707   7.382   8.527
   36   2H5*    U   4          2H5*        U   4   7.596   7.810  10.244
   37    H4*    U   4           H4*        U   4   5.438   8.157   9.086
   38    H3*    U   4           H3*        U   4   5.506   5.929  11.130
   39    H2*    U   4           H2*        U   4   3.150   5.700  10.819
   40   2HO*    U   4          2HO*        U   4   2.415   7.771  10.670
   41    H1*    U   4           H1*        U   4   3.237   5.949   8.086
   42    H3     U   4           H3         U   4   1.980   1.678   9.258
   43    H5     U   4           H5         U   4   6.173   1.662   9.474
   44    H6     U   4           H6         U   4   6.168   4.047   9.083
   45   1H5*    A   5          1H5*        A   5   2.298   9.092  11.957
   46   2H5*    A   5          2H5*        A   5   2.125   9.226  13.716
   47    H4*    A   5           H4*        A   5  -0.050   8.829  12.576
   48    H3*    A   5           H3*        A   5   0.930   6.617  14.405
   49    H2*    A   5           H2*        A   5  -1.239   5.621  14.122
   50   2HO*    A   5          2HO*        A   5  -2.414   7.663  14.140
   51    H1*    A   5           H1*        A   5  -1.257   5.993  11.394
   52    H8     A   5           H8         A   5   2.256   5.181  12.763
   53   1H6     A   5          1H6         A   5   0.755  -0.698  11.461
   54   2H6     A   5          2H6         A   5   2.098   0.371  11.846
   55    H2     A   5           H2         A   5  -2.914   1.684  11.195
   56   1H5*    A   6          1H5*        A   6  -3.364   7.929  17.878
   57   2H5*    A   6          2H5*        A   6  -3.421   6.463  16.876
   58    H4*    A   6           H4*        A   6  -4.859   9.106  16.330
   59    H3*    A   6           H3*        A   6  -5.744   6.397  17.337
   60    H2*    A   6           H2*        A   6  -7.795   6.584  16.130
   61   2HO*    A   6          2HO*        A   6  -7.750   9.007  16.542
   62    H1*    A   6           H1*        A   6  -6.635   7.252  13.789
   63    H8     A   6           H8         A   6  -3.780   5.300  14.981
   64   1H6     A   6          1H6         A   6  -7.021   0.204  13.605
   65   2H6     A   6          2H6         A   6  -5.422   0.803  14.032
   66    H2     A   6           H2         A   6  -9.859   3.572  13.773
   67   1H5*    G   7          1H5*        G   7  -8.858   7.090  18.432
   68   2H5*    G   7          2H5*        G   7  -9.231   6.588  20.093
   69    H4*    G   7           H4*        G   7 -10.181   5.087  18.327
   70    H3*    G   7           H3*        G   7  -8.110   3.842  20.159
   71    H2*    G   7           H2*        G   7  -8.726   1.742  19.098
   72   2HO*    G   7          2HO*        G   7 -11.030   2.527  18.919
   73    H1*    G   7           H1*        G   7  -8.639   2.764  16.572
   74    H8     G   7           H8         G   7  -5.802   4.477  18.388
   75    H1     G   7           H1         G   7  -4.623  -1.721  17.098
   76   1H2     G   7          2H2         G   7  -6.512  -2.727  16.475
   77   2H2     G   7          1H2         G   7  -8.011  -1.810  16.305
   78   1H5*    A   8          1H5*        A   8 -11.600   1.314  20.145
   79   2H5*    A   8          2H5*        A   8 -11.886   0.614  21.742
   80    H4*    A   8           H4*        A   8 -11.608  -1.057  19.864
   81    H3*    A   8           H3*        A   8  -9.737  -1.140  22.239
   82    H2*    A   8           H2*        A   8  -8.866  -3.200  21.300
   83   2HO*    A   8          2HO*        A   8 -11.144  -3.722  20.542
   84    H1*    A   8           H1*        A   8  -8.706  -2.251  18.740
   85    H8     A   8           H8         A   8  -7.652   0.721  20.784
   86   1H6     A   8          1H6         A   8  -2.013  -1.942  20.655
   87   2H6     A   8          2H6         A   8  -2.882  -0.439  20.938
   88    H2     A   8           H2         A   8  -4.994  -5.001  19.526
   89   1H5*    C   9          1H5*        C   9 -11.348  -5.130  21.911
   90   2H5*    C   9          2H5*        C   9 -11.742  -5.751  23.527
   91    H4*    C   9           H4*        C   9 -10.088  -7.195  22.361
   92    H3*    C   9           H3*        C   9  -9.058  -5.682  24.789
   93    H2*    C   9           H2*        C   9  -7.026  -6.895  24.573
   94   2HO*    C   9          2HO*        C   9  -6.845  -8.628  23.066
   95    H1*    C   9           H1*        C   9  -6.951  -6.694  21.794
   96   1H4     C   9          2H4         C   9  -3.045  -2.182  23.748
   97   2H4     C   9          1H4         C   9  -4.360  -1.041  24.033
   98    H5     C   9           H5         C   9  -6.734  -1.751  23.883
   99    H6     C   9           H6         C   9  -8.185  -3.595  23.334
  100    H3T    C   9           H3T        C   9  -9.490  -8.439  24.530
  101   1H5*    G  10          1H5*        G  10   6.774  -5.596  22.643
  102   2H5*    G  10          2H5*        G  10   7.012  -6.744  21.318
  103    H4*    G  10           H4*        G  10   5.760  -7.984  22.824
  104    H3*    G  10           H3*        G  10   3.755  -6.707  20.934
  105    H2*    G  10           H2*        G  10   2.063  -7.945  21.974
  106   2HO*    G  10          2HO*        G  10   3.582  -9.820  22.254
  107    H1*    G  10           H1*        G  10   2.897  -7.378  24.506
  108    H8     G  10           H8         G  10   3.790  -4.103  23.324
  109    H1     G  10           H1         G  10  -2.592  -4.892  23.157
  110   1H2     G  10          2H2         G  10  -3.063  -7.073  22.996
  111   2H2     G  10          1H2         G  10  -1.791  -8.292  23.110
  112    H5T    G  10           H5T        G  10   5.469  -5.727  20.117
  113   1H5*    U  11          1H5*        U  11   2.899 -10.396  19.677
  114   2H5*    U  11          2H5*        U  11   2.880 -10.476  17.907
  115    H4*    U  11           H4*        U  11   0.647 -10.844  18.841
  116    H3*    U  11           H3*        U  11   0.976  -8.225  17.358
  117    H2*    U  11           H2*        U  11  -1.405  -7.949  17.634
  118   2HO*    U  11          2HO*        U  11  -1.775 -10.288  17.308
  119    H1*    U  11           H1*        U  11  -1.453  -8.698  20.234
  120    H3     U  11           H3         U  11  -2.259  -4.203  19.942
  121    H5     U  11           H5         U  11   1.929  -4.557  20.059
  122    H6     U  11           H6         U  11   1.688  -6.954  19.857
  123   1H5*    C  12          1H5*        C  12  -2.503 -10.321  15.582
  124   2H5*    C  12          2H5*        C  12  -2.542  -9.948  13.851
  125    H4*    C  12           H4*        C  12  -4.629  -9.313  15.105
  126    H3*    C  12           H3*        C  12  -3.059  -7.131  13.709
  127    H2*    C  12           H2*        C  12  -4.868  -5.653  14.291
  128   2HO*    C  12          2HO*        C  12  -6.415  -7.516  13.888
  129    H1*    C  12           H1*        C  12  -5.193  -6.634  16.846
  130   1H4     C  12          2H4         C  12  -1.839  -1.359  17.484
  131   2H4     C  12          1H4         C  12  -0.304  -2.215  17.316
  132    H5     C  12           H5         C  12  -0.244  -4.616  16.638
  133    H6     C  12           H6         C  12  -1.622  -6.543  16.160
  134   1H5*    G  13          1H5*        G  13  -6.913  -6.114  12.410
  135   2H5*    G  13          2H5*        G  13  -6.820  -5.718  10.688
  136    H4*    G  13           H4*        G  13  -7.593  -3.807  12.000
  137    H3*    G  13           H3*        G  13  -4.844  -3.445  10.782
  138    H2*    G  13           H2*        G  13  -5.023  -1.133  11.485
  139   2HO*    G  13          2HO*        G  13  -7.360  -1.020  11.046
  140    H1*    G  13           H1*        G  13  -5.817  -1.765  14.014
  141    H8     G  13           H8         G  13  -3.494  -4.520  12.763
  142    H1     G  13           H1         G  13  -0.344   0.619  14.959
  143   1H2     G  13          1H2         G  13  -1.750   2.302  15.300
  144   2H2     G  13          2H2         G  13  -3.450   2.173  14.924
  145   1H5*    A  14          1H5*        A  14  -8.904  -1.676   9.196
  146   2H5*    A  14          2H5*        A  14  -8.700  -0.980   7.579
  147    H4*    A  14           H4*        A  14 -10.341   0.187   9.096
  148    H3*    A  14           H3*        A  14  -8.032   1.816   8.020
  149    H2*    A  14           H2*        A  14  -9.161   3.727   8.976
  150   2HO*    A  14          2HO*        A  14 -11.376   2.889   8.607
  151    H1*    A  14           H1*        A  14  -9.442   2.555  11.382
  152    H8     A  14           H8         A  14  -6.302   0.866  10.658
  153   1H6     A  14          1H6         A  14  -3.490   6.274  11.891
  154   2H6     A  14          2H6         A  14  -3.235   4.536  11.713
  155    H2     A  14           H2         A  14  -7.711   7.113  10.923
  156   1H5*    A  15          1H5*        A  15  -8.722   4.391   4.781
  157   2H5*    A  15          2H5*        A  15  -7.763   3.690   6.107
  158    H4*    A  15           H4*        A  15  -8.924   6.517   6.128
  159    H3*    A  15           H3*        A  15  -6.270   5.478   5.143
  160    H2*    A  15           H2*        A  15  -5.184   7.425   6.038
  161   2HO*    A  15          2HO*        A  15  -7.233   8.693   5.449
  162    H1*    A  15           H1*        A  15  -6.408   7.344   8.461
  163    H8     A  15           H8         A  15  -6.317   3.743   7.959
  164   1H6     A  15          1H6         A  15  -0.130   3.918   8.680
  165   2H6     A  15          2H6         A  15  -1.513   2.835   8.472
  166    H2     A  15           H2         A  15  -1.581   8.056   8.487
  167   1H5*    G  16          1H5*        G  16  -5.809   9.367   4.008
  168   2H5*    G  16          2H5*        G  16  -5.322   9.459   2.305
  169    H4*    G  16           H4*        G  16  -3.658  10.502   3.807
  170    H3*    G  16           H3*        G  16  -2.793   8.005   2.331
  171    H2*    G  16           H2*        G  16  -0.575   8.401   3.209
  172   2HO*    G  16          2HO*        G  16  -0.956  10.801   3.002
  173    H1*    G  16           H1*        G  16  -1.413   8.894   5.754
  174    H8     G  16           H8         G  16  -3.789   6.208   4.634
  175    H1     G  16           H1         G  16   2.152   4.016   5.764
  176   1H2     G  16          1H2         G  16   3.539   5.544   5.671
  177   2H2     G  16          2H2         G  16   3.237   7.207   5.488
  178   1H5*    C  17          1H5*        C  17   0.207  11.039   1.556
  179   2H5*    C  17          2H5*        C  17   0.702  10.970  -0.143
  180    H4*    C  17           H4*        C  17   2.596  10.739   1.480
  181    H3*    C  17           H3*        C  17   2.019   8.423  -0.386
  182    H2*    C  17           H2*        C  17   4.076   7.455   0.437
  183   2HO*    C  17          2HO*        C  17   4.978   9.756   0.606
  184    H1*    C  17           H1*        C  17   3.574   8.044   3.063
  185   1H4     C  17          2H4         C  17   1.674   2.092   2.642
  186   2H4     C  17          1H4         C  17   0.002   2.597   2.404
  187    H5     C  17           H5         C  17  -0.555   4.959   1.819
  188    H6     C  17           H6         C  17   0.362   7.192   1.647
  189   1H5*    C  18          1H5*        C  18   6.183   9.415  -0.727
  190   2H5*    C  18          2H5*        C  18   6.686   9.507  -2.416
  191    H4*    C  18           H4*        C  18   8.073   7.987  -0.934
  192    H3*    C  18           H3*        C  18   7.429   7.631  -3.619
  193    H2*    C  18           H2*        C  18   5.644   6.119  -3.213
  194   2HO*    C  18          2HO*        C  18   6.531   3.960  -3.517
  195    H1*    C  18           H1*        C  18   7.365   4.871  -1.041
  196   1H4     C  18          2H4         C  18   2.250   1.246  -0.345
  197   2H4     C  18          1H4         C  18   1.112   2.584  -0.510
  198    H5     C  18           H5         C  18   1.914   4.894  -1.017
  199    H6     C  18           H6         C  18   3.899   6.245  -1.350
  200    H3T    C  18           H3T        C  18   8.932   5.710  -3.219
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1   5.931  -8.573   0.156
    2   2H5*    G   1          2H5*        G   1   6.563  -8.490   1.808
    3    H4*    G   1           H4*        G   1   8.091  -7.312   0.385
    4    H3*    G   1           H3*        G   1   6.370  -5.383   1.969
    5    H2*    G   1           H2*        G   1   7.796  -3.641   1.151
    6   2HO*    G   1          2HO*        G   1   9.717  -5.101   1.259
    7    H1*    G   1           H1*        G   1   7.698  -4.513  -1.431
    8    H8     G   1           H8         G   1   4.270  -5.402  -0.273
    9    H1     G   1           H1         G   1   5.038   0.957  -0.902
   10   1H2     G   1          2H2         G   1   7.225   1.435  -1.027
   11   2H2     G   1          1H2         G   1   8.434   0.149  -1.037
   12    H5T    G   1           H5T        G   1   5.045  -6.922   2.293
   13   1H5*    G   2          1H5*        G   2  10.270  -4.206   2.985
   14   2H5*    G   2          2H5*        G   2  10.348  -3.809   4.710
   15    H4*    G   2           H4*        G   2  11.017  -1.926   3.222
   16    H3*    G   2           H3*        G   2   8.565  -1.532   4.951
   17    H2*    G   2           H2*        G   2   8.573   0.762   4.193
   18   2HO*    G   2          2HO*        G   2  11.009   0.732   4.193
   19    H1*    G   2           H1*        G   2   8.986   0.150   1.575
   20    H8     G   2           H8         G   2   6.651  -2.547   2.816
   21    H1     G   2           H1         G   2   3.841   3.213   2.239
   22   1H2     G   2          2H2         G   2   5.452   4.804   2.119
   23   2H2     G   2          1H2         G   2   7.152   4.339   2.026
   24   1H5*    C   3          1H5*        C   3  11.109   1.936   5.639
   25   2H5*    C   3          2H5*        C   3  11.084   2.333   7.364
   26    H4*    C   3           H4*        C   3  10.398   4.227   5.874
   27    H3*    C   3           H3*        C   3   8.356   3.172   7.851
   28    H2*    C   3           H2*        C   3   7.013   5.062   7.204
   29   2HO*    C   3          2HO*        C   3   9.061   6.386   7.013
   30    H1*    C   3           H1*        C   3   7.506   4.815   4.522
   31   1H4     C   3          2H4         C   3   1.900   1.921   5.413
   32   2H4     C   3          1H4         C   3   2.756   0.415   5.632
   33    H5     C   3           H5         C   3   5.162   0.226   5.866
   34    H6     C   3           H6         C   3   7.244   1.436   5.784
   35   1H5*    U   4          1H5*        U   4   7.904   7.179   8.632
   36   2H5*    U   4          2H5*        U   4   7.784   7.432  10.382
   37    H4*    U   4           H4*        U   4   5.723   8.116   9.203
   38    H3*    U   4           H3*        U   4   5.439   5.712  11.024
   39    H2*    U   4           H2*        U   4   3.054   5.897  10.617
   40   2HO*    U   4          2HO*        U   4   3.191   8.292  10.563
   41    H1*    U   4           H1*        U   4   3.330   6.231   7.920
   42    H3     U   4           H3         U   4   1.610   2.045   8.735
   43    H5     U   4           H5         U   4   5.763   1.595   9.130
   44    H6     U   4           H6         U   4   6.007   3.986   8.946
   45   1H5*    A   5          1H5*        A   5   2.374   8.639  12.137
   46   2H5*    A   5          2H5*        A   5   2.127   8.579  13.888
   47    H4*    A   5           H4*        A   5   0.044   8.166  12.605
   48    H3*    A   5           H3*        A   5   1.059   5.823  14.243
   49    H2*    A   5           H2*        A   5  -1.080   4.806  13.760
   50   2HO*    A   5          2HO*        A   5  -2.297   6.830  13.894
   51    H1*    A   5           H1*        A   5  -0.952   5.410  11.086
   52    H8     A   5           H8         A   5   2.563   4.679  12.411
   53   1H6     A   5          1H6         A   5   1.160  -1.319  11.630
   54   2H6     A   5          2H6         A   5   2.485  -0.191  11.898
   55    H2     A   5           H2         A   5  -2.536   0.986  11.070
   56   1H5*    A   6          1H5*        A   6  -2.421   8.795  15.273
   57   2H5*    A   6          2H5*        A   6  -2.893   8.622  16.976
   58    H4*    A   6           H4*        A   6  -4.795   9.142  15.426
   59    H3*    A   6           H3*        A   6  -4.882   6.521  16.943
   60    H2*    A   6           H2*        A   6  -7.119   6.275  16.051
   61   2HO*    A   6          2HO*        A   6  -7.415   8.691  16.241
   62    H1*    A   6           H1*        A   6  -6.429   6.931  13.501
   63    H8     A   6           H8         A   6  -3.439   5.016  14.760
   64   1H6     A   6          1H6         A   6  -6.790  -0.088  13.657
   65   2H6     A   6          2H6         A   6  -5.177   0.490  14.066
   66    H2     A   6           H2         A   6  -9.528   3.350  13.518
   67   1H5*    G   7          1H5*        G   7  -8.567   7.193  17.783
   68   2H5*    G   7          2H5*        G   7  -8.908   6.899  19.499
   69    H4*    G   7           H4*        G   7 -10.047   5.282  17.990
   70    H3*    G   7           H3*        G   7  -7.956   4.134  19.855
   71    H2*    G   7           H2*        G   7  -8.663   1.951  19.060
   72   2HO*    G   7          2HO*        G   7 -10.953   2.821  18.867
   73    H1*    G   7           H1*        G   7  -8.638   2.643  16.432
   74    H8     G   7           H8         G   7  -5.728   4.564  17.889
   75    H1     G   7           H1         G   7  -4.602  -1.750  17.378
   76   1H2     G   7          2H2         G   7  -6.514  -2.818  16.955
   77   2H2     G   7          1H2         G   7  -8.018  -1.925  16.715
   78   1H5*    A   8          1H5*        A   8 -11.423   1.641  20.234
   79   2H5*    A   8          2H5*        A   8 -11.683   1.195  21.925
   80    H4*    A   8           H4*        A   8 -11.411  -0.762  20.350
   81    H3*    A   8           H3*        A   8  -9.452  -0.404  22.622
   82    H2*    A   8           H2*        A   8  -8.572  -2.565  22.041
   83   2HO*    A   8          2HO*        A   8  -9.545  -3.937  20.624
   84    H1*    A   8           H1*        A   8  -8.559  -2.075  19.332
   85    H8     A   8           H8         A   8  -7.405   1.174  20.816
   86   1H6     A   8          1H6         A   8  -1.784  -1.540  20.812
   87   2H6     A   8          2H6         A   8  -2.630   0.000  20.894
   88    H2     A   8           H2         A   8  -4.831  -4.703  20.341
   89   1H5*    C   9          1H5*        C   9 -11.026  -4.349  22.923
   90   2H5*    C   9          2H5*        C   9 -11.438  -4.745  24.602
   91    H4*    C   9           H4*        C   9  -9.851  -6.399  23.715
   92    H3*    C   9           H3*        C   9  -8.636  -4.499  25.765
   93    H2*    C   9           H2*        C   9  -6.694  -5.878  25.716
   94   2HO*    C   9          2HO*        C   9  -8.133  -7.838  25.493
   95    H1*    C   9           H1*        C   9  -6.714  -6.155  22.961
   96   1H4     C   9          2H4         C   9  -2.658  -1.435  23.948
   97   2H4     C   9          1H4         C   9  -3.945  -0.243  24.147
   98    H5     C   9           H5         C   9  -6.328  -0.926  24.234
   99    H6     C   9           H6         C   9  -7.823  -2.803  24.044
  100    H3T    C   9           H3T        C   9 -10.310  -5.816  26.551
  101   1H5*    G  10          1H5*        G  10   7.067  -5.070  22.819
  102   2H5*    G  10          2H5*        G  10   7.234  -6.363  21.623
  103    H4*    G  10           H4*        G  10   6.044  -7.410  23.315
  104    H3*    G  10           H3*        G  10   3.964  -6.328  21.385
  105    H2*    G  10           H2*        G  10   2.312  -7.418  22.631
  106   2HO*    G  10          2HO*        G  10   3.822  -9.274  23.049
  107    H1*    G  10           H1*        G  10   3.268  -6.588  25.046
  108    H8     G  10           H8         G  10   4.120  -3.480  23.432
  109    H1     G  10           H1         G  10  -2.266  -4.209  23.708
  110   1H2     G  10          2H2         G  10  -2.759  -6.387  23.855
  111   2H2     G  10          1H2         G  10  -1.489  -7.597  24.045
  112    H5T    G  10           H5T        G  10   5.643  -5.467  20.387
  113   1H5*    U  11          1H5*        U  11   3.037 -10.129  20.597
  114   2H5*    U  11          2H5*        U  11   2.910 -10.405  18.852
  115    H4*    U  11           H4*        U  11   0.738 -10.641  19.961
  116    H3*    U  11           H3*        U  11   0.980  -8.217  18.163
  117    H2*    U  11           H2*        U  11  -1.380  -7.896  18.551
  118   2HO*    U  11          2HO*        U  11  -1.767 -10.256  18.532
  119    H1*    U  11           H1*        U  11  -1.264  -8.324  21.220
  120    H3     U  11           H3         U  11  -2.078  -3.887  20.428
  121    H5     U  11           H5         U  11   2.109  -4.270  20.340
  122    H6     U  11           H6         U  11   1.848  -6.670  20.441
  123   1H5*    C  12          1H5*        C  12  -2.598 -10.463  16.873
  124   2H5*    C  12          2H5*        C  12  -2.772 -10.285  15.120
  125    H4*    C  12           H4*        C  12  -4.746  -9.485  16.470
  126    H3*    C  12           H3*        C  12  -3.302  -7.514  14.681
  127    H2*    C  12           H2*        C  12  -5.044  -5.945  15.235
  128   2HO*    C  12          2HO*        C  12  -6.624  -7.830  15.211
  129    H1*    C  12           H1*        C  12  -5.143  -6.603  17.912
  130   1H4     C  12          2H4         C  12  -1.758  -1.333  17.597
  131   2H4     C  12          1H4         C  12  -0.235  -2.215  17.447
  132    H5     C  12           H5         C  12  -0.227  -4.688  17.071
  133    H6     C  12           H6         C  12  -1.641  -6.645  16.945
  134   1H5*    G  13          1H5*        G  13  -7.178  -6.470  13.662
  135   2H5*    G  13          2H5*        G  13  -7.262  -6.357  11.898
  136    H4*    G  13           H4*        G  13  -7.791  -4.209  12.918
  137    H3*    G  13           H3*        G  13  -5.151  -4.269  11.439
  138    H2*    G  13           H2*        G  13  -5.087  -1.881  11.738
  139   2HO*    G  13          2HO*        G  13  -7.418  -1.617  11.408
  140    H1*    G  13           H1*        G  13  -5.765  -1.986  14.392
  141    H8     G  13           H8         G  13  -3.666  -5.028  13.392
  142    H1     G  13           H1         G  13  -0.144   0.157  14.781
  143   1H2     G  13          1H2         G  13  -1.455   1.933  15.059
  144   2H2     G  13          2H2         G  13  -3.178   1.849  14.814
  145   1H5*    A  14          1H5*        A  14  -9.220  -2.347   9.913
  146   2H5*    A  14          2H5*        A  14  -9.073  -2.126   8.158
  147    H4*    A  14           H4*        A  14 -10.417  -0.351   9.284
  148    H3*    A  14           H3*        A  14  -7.884   0.458   7.852
  149    H2*    A  14           H2*        A  14  -8.419   2.732   8.358
  150   2HO*    A  14          2HO*        A  14 -10.692   2.457   7.863
  151    H1*    A  14           H1*        A  14  -9.301   2.272  10.927
  152    H8     A  14           H8         A  14  -6.213   0.158  10.509
  153   1H6     A  14          1H6         A  14  -3.147   5.488  11.633
  154   2H6     A  14          2H6         A  14  -2.929   3.746  11.469
  155    H2     A  14           H2         A  14  -7.303   6.474  10.639
  156   1H5*    A  15          1H5*        A  15  -8.311   3.475   4.217
  157   2H5*    A  15          2H5*        A  15  -7.267   3.016   5.569
  158    H4*    A  15           H4*        A  15  -9.207   5.374   5.622
  159    H3*    A  15           H3*        A  15  -6.325   5.091   4.798
  160    H2*    A  15           H2*        A  15  -5.713   7.111   5.913
  161   2HO*    A  15          2HO*        A  15  -7.954   7.989   5.288
  162    H1*    A  15           H1*        A  15  -6.996   6.579   8.231
  163    H8     A  15           H8         A  15  -6.250   3.116   7.509
  164   1H6     A  15          1H6         A  15  -0.233   4.238   8.579
  165   2H6     A  15          2H6         A  15  -1.433   2.966   8.305
  166    H2     A  15           H2         A  15  -2.325   8.104   8.477
  167   1H5*    G  16          1H5*        G  16  -6.225   8.939   4.144
  168   2H5*    G  16          2H5*        G  16  -5.757   9.280   2.467
  169    H4*    G  16           H4*        G  16  -4.161  10.257   4.065
  170    H3*    G  16           H3*        G  16  -3.143   8.006   2.320
  171    H2*    G  16           H2*        G  16  -0.951   8.409   3.241
  172   2HO*    G  16          2HO*        G  16  -1.479  10.800   3.284
  173    H1*    G  16           H1*        G  16  -1.785   8.612   5.829
  174    H8     G  16           H8         G  16  -4.044   5.937   4.523
  175    H1     G  16           H1         G  16   1.976   3.888   5.496
  176   1H2     G  16          1H2         G  16   3.310   5.440   5.481
  177   2H2     G  16          2H2         G  16   2.978   7.104   5.369
  178   1H5*    C  17          1H5*        C  17  -0.272  11.215   1.845
  179   2H5*    C  17          2H5*        C  17   0.130  11.363   0.124
  180    H4*    C  17           H4*        C  17   2.134  10.990   1.546
  181    H3*    C  17           H3*        C  17   1.411   8.812  -0.432
  182    H2*    C  17           H2*        C  17   3.512   7.780   0.146
  183   2HO*    C  17          2HO*        C  17   4.498  10.004   0.326
  184    H1*    C  17           H1*        C  17   3.243   8.231   2.850
  185   1H4     C  17          2H4         C  17   1.337   2.275   2.197
  186   2H4     C  17          1H4         C  17  -0.335   2.777   1.958
  187    H5     C  17           H5         C  17  -0.925   5.159   1.552
  188    H6     C  17           H6         C  17  -0.046   7.411   1.524
  189   1H5*    C  18          1H5*        C  18   5.648   9.901  -1.219
  190   2H5*    C  18          2H5*        C  18   5.837   9.956  -2.982
  191    H4*    C  18           H4*        C  18   7.469   8.412  -1.926
  192    H3*    C  18           H3*        C  18   5.346   7.143  -3.695
  193    H2*    C  18           H2*        C  18   6.495   5.083  -3.438
  194   2HO*    C  18          2HO*        C  18   8.578   4.987  -2.490
  195    H1*    C  18           H1*        C  18   7.131   5.506  -0.734
  196   1H4     C  18          2H4         C  18   2.331   1.426  -0.711
  197   2H4     C  18          1H4         C  18   1.135   2.710  -0.864
  198    H5     C  18           H5         C  18   1.811   5.054  -1.343
  199    H6     C  18           H6         C  18   3.711   6.529  -1.600
  200    H3T    C  18           H3T        C  18   8.084   7.394  -4.217
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1   4.642  -8.130   0.951
    2   2H5*    G   1          2H5*        G   1   5.737  -8.271   2.333
    3    H4*    G   1           H4*        G   1   7.126  -7.480   0.641
    4    H3*    G   1           H3*        G   1   6.165  -5.037   2.171
    5    H2*    G   1           H2*        G   1   7.677  -3.749   0.908
    6   2HO*    G   1          2HO*        G   1   9.278  -5.556   0.867
    7    H1*    G   1           H1*        G   1   6.869  -4.800  -1.462
    8    H8     G   1           H8         G   1   3.591  -5.105   0.077
    9    H1     G   1           H1         G   1   5.130   1.082  -0.769
   10   1H2     G   1          2H2         G   1   7.355   1.283  -0.925
   11   2H2     G   1          1H2         G   1   8.397  -0.140  -0.954
   12    H5T    G   1           H5T        G   1   4.917  -6.414   3.205
   13   1H5*    G   2          1H5*        G   2   9.979  -4.658   3.391
   14   2H5*    G   2          2H5*        G   2  10.045  -4.280   5.120
   15    H4*    G   2           H4*        G   2  10.852  -2.434   3.683
   16    H3*    G   2           H3*        G   2   8.324  -1.877   5.251
   17    H2*    G   2           H2*        G   2   8.546   0.400   4.482
   18   2HO*    G   2          2HO*        G   2  10.967   0.208   4.661
   19    H1*    G   2           H1*        G   2   9.115  -0.268   1.899
   20    H8     G   2           H8         G   2   6.500  -2.759   2.897
   21    H1     G   2           H1         G   2   4.195   3.239   2.451
   22   1H2     G   2          2H2         G   2   5.933   4.689   2.397
   23   2H2     G   2          1H2         G   2   7.587   4.083   2.315
   24   1H5*    C   3          1H5*        C   3  11.086   1.371   6.112
   25   2H5*    C   3          2H5*        C   3  10.999   1.781   7.833
   26    H4*    C   3           H4*        C   3  10.554   3.712   6.279
   27    H3*    C   3           H3*        C   3   8.376   2.856   8.205
   28    H2*    C   3           H2*        C   3   7.184   4.820   7.482
   29   2HO*    C   3          2HO*        C   3   9.326   5.993   7.339
   30    H1*    C   3           H1*        C   3   7.747   4.498   4.823
   31   1H4     C   3          2H4         C   3   1.917   2.069   5.545
   32   2H4     C   3          1H4         C   3   2.642   0.487   5.700
   33    H5     C   3           H5         C   3   5.023   0.097   5.992
   34    H6     C   3           H6         C   3   7.194   1.141   5.993
   35   1H5*    U   4          1H5*        U   4   7.865   6.740   8.913
   36   2H5*    U   4          2H5*        U   4   7.790   7.017  10.662
   37    H4*    U   4           H4*        U   4   5.644   7.584   9.593
   38    H3*    U   4           H3*        U   4   5.603   5.130  11.363
   39    H2*    U   4           H2*        U   4   3.230   5.090  11.066
   40   2HO*    U   4          2HO*        U   4   2.484   7.114  11.093
   41    H1*    U   4           H1*        U   4   3.319   5.620   8.375
   42    H3     U   4           H3         U   4   1.868   1.300   9.033
   43    H5     U   4           H5         U   4   6.050   1.074   9.311
   44    H6     U   4           H6         U   4   6.155   3.483   9.186
   45   1H5*    A   5          1H5*        A   5   2.698   8.378  12.668
   46   2H5*    A   5          2H5*        A   5   2.477   8.287  14.427
   47    H4*    A   5           H4*        A   5   0.323   8.198  13.168
   48    H3*    A   5           H3*        A   5   1.066   5.704  14.726
   49    H2*    A   5           H2*        A   5  -1.157   4.911  14.202
   50   2HO*    A   5          2HO*        A   5  -2.205   6.991  14.413
   51    H1*    A   5           H1*        A   5  -0.965   5.600  11.551
   52    H8     A   5           H8         A   5   2.394   4.395  13.041
   53   1H6     A   5          1H6         A   5   0.615  -1.175  10.965
   54   2H6     A   5          2H6         A   5   1.988  -0.261  11.574
   55    H2     A   5           H2         A   5  -2.849   1.489  10.706
   56   1H5*    A   6          1H5*        A   6  -2.325   8.818  15.854
   57   2H5*    A   6          2H5*        A   6  -2.797   8.558  17.545
   58    H4*    A   6           H4*        A   6  -4.706   9.155  16.042
   59    H3*    A   6           H3*        A   6  -4.785   6.436  17.380
   60    H2*    A   6           H2*        A   6  -7.018   6.252  16.477
   61   2HO*    A   6          2HO*        A   6  -7.320   8.647  16.859
   62    H1*    A   6           H1*        A   6  -6.351   7.140  13.984
   63    H8     A   6           H8         A   6  -3.420   5.046  15.128
   64   1H6     A   6          1H6         A   6  -6.831   0.171  13.314
   65   2H6     A   6          2H6         A   6  -5.214   0.659  13.814
   66    H2     A   6           H2         A   6  -9.496   3.659  13.531
   67   1H5*    G   7          1H5*        G   7  -8.556   7.143  18.242
   68   2H5*    G   7          2H5*        G   7  -8.901   6.695  19.924
   69    H4*    G   7           H4*        G   7 -10.100   5.264  18.294
   70    H3*    G   7           H3*        G   7  -8.007   3.870  19.980
   71    H2*    G   7           H2*        G   7  -8.789   1.803  18.969
   72   2HO*    G   7          2HO*        G   7 -11.055   2.744  18.907
   73    H1*    G   7           H1*        G   7  -8.759   2.759  16.433
   74    H8     G   7           H8         G   7  -5.821   4.473  18.098
   75    H1     G   7           H1         G   7  -4.767  -1.755  16.892
   76   1H2     G   7          2H2         G   7  -6.680  -2.745  16.338
   77   2H2     G   7          1H2         G   7  -8.176  -1.819  16.183
   78   1H5*    A   8          1H5*        A   8 -11.558   1.470  20.163
   79   2H5*    A   8          2H5*        A   8 -11.791   0.810  21.785
   80    H4*    A   8           H4*        A   8 -11.629  -0.908  19.941
   81    H3*    A   8           H3*        A   8  -9.658  -0.974  22.232
   82    H2*    A   8           H2*        A   8  -8.852  -3.064  21.305
   83   2HO*    A   8          2HO*        A   8 -11.173  -3.560  20.650
   84    H1*    A   8           H1*        A   8  -8.781  -2.177  18.719
   85    H8     A   8           H8         A   8  -7.618   0.851  20.598
   86   1H6     A   8          1H6         A   8  -2.021  -1.887  20.420
   87   2H6     A   8          2H6         A   8  -2.867  -0.363  20.648
   88    H2     A   8           H2         A   8  -5.078  -4.967  19.560
   89   1H5*    C   9          1H5*        C   9 -11.269  -4.947  22.085
   90   2H5*    C   9          2H5*        C   9 -11.631  -5.508  23.730
   91    H4*    C   9           H4*        C   9 -10.002  -6.996  22.591
   92    H3*    C   9           H3*        C   9  -8.919  -5.385  24.931
   93    H2*    C   9           H2*        C   9  -6.891  -6.605  24.720
   94   2HO*    C   9          2HO*        C   9  -6.740  -8.398  23.281
   95    H1*    C   9           H1*        C   9  -6.877  -6.518  21.935
   96   1H4     C   9          2H4         C   9  -2.931  -1.928  23.584
   97   2H4     C   9          1H4         C   9  -4.240  -0.766  23.815
   98    H5     C   9           H5         C   9  -6.618  -1.478  23.749
   99    H6     C   9           H6         C   9  -8.081  -3.347  23.333
  100    H3T    C   9           H3T        C   9  -9.352  -8.151  24.794
  101   1H5*    G  10          1H5*        G  10   6.831  -5.468  22.267
  102   2H5*    G  10          2H5*        G  10   6.997  -6.685  20.994
  103    H4*    G  10           H4*        G  10   5.817  -7.836  22.624
  104    H3*    G  10           H3*        G  10   3.724  -6.647  20.771
  105    H2*    G  10           H2*        G  10   2.083  -7.818  21.959
  106   2HO*    G  10          2HO*        G  10   3.606  -9.685  22.260
  107    H1*    G  10           H1*        G  10   3.046  -7.125  24.413
  108    H8     G  10           H8         G  10   3.886  -3.920  23.017
  109    H1     G  10           H1         G  10  -2.498  -4.686  23.183
  110   1H2     G  10          2H2         G  10  -2.980  -6.870  23.156
  111   2H2     G  10          1H2         G  10  -1.708  -8.087  23.291
  112    H5T    G  10           H5T        G  10   5.402  -5.721  19.820
  113   1H5*    U  11          1H5*        U  11   2.808 -10.400  19.732
  114   2H5*    U  11          2H5*        U  11   2.690 -10.559  17.972
  115    H4*    U  11           H4*        U  11   0.512 -10.872  19.051
  116    H3*    U  11           H3*        U  11   0.759  -8.332  17.422
  117    H2*    U  11           H2*        U  11  -1.602  -8.036  17.820
  118   2HO*    U  11          2HO*        U  11  -1.965 -10.406  17.647
  119    H1*    U  11           H1*        U  11  -1.498  -8.646  20.456
  120    H3     U  11           H3         U  11  -2.309  -4.167  19.933
  121    H5     U  11           H5         U  11   1.879  -4.541  19.862
  122    H6     U  11           H6         U  11   1.618  -6.944  19.811
  123   1H5*    C  12          1H5*        C  12  -2.825 -10.426  15.979
  124   2H5*    C  12          2H5*        C  12  -2.970 -10.161  14.235
  125    H4*    C  12           H4*        C  12  -4.951  -9.397  15.596
  126    H3*    C  12           H3*        C  12  -3.456  -7.372  13.913
  127    H2*    C  12           H2*        C  12  -5.180  -5.802  14.515
  128   2HO*    C  12          2HO*        C  12  -6.789  -7.657  14.390
  129    H1*    C  12           H1*        C  12  -5.327  -6.571  17.156
  130   1H4     C  12          2H4         C  12  -1.868  -1.369  17.241
  131   2H4     C  12          1H4         C  12  -0.352  -2.271  17.136
  132    H5     C  12           H5         C  12  -0.365  -4.722  16.619
  133    H6     C  12           H6         C  12  -1.806  -6.641  16.321
  134   1H5*    G  13          1H5*        G  13  -7.312  -6.220  12.918
  135   2H5*    G  13          2H5*        G  13  -7.385  -6.031  11.160
  136    H4*    G  13           H4*        G  13  -7.885  -3.920  12.265
  137    H3*    G  13           H3*        G  13  -5.239  -3.965  10.796
  138    H2*    G  13           H2*        G  13  -5.109  -1.606  11.206
  139   2HO*    G  13          2HO*        G  13  -7.452  -1.286  10.864
  140    H1*    G  13           H1*        G  13  -5.838  -1.797  13.847
  141    H8     G  13           H8         G  13  -3.780  -4.829  12.718
  142    H1     G  13           H1         G  13  -0.188   0.158  14.568
  143   1H2     G  13          1H2         G  13  -1.463   1.937  14.936
  144   2H2     G  13          2H2         G  13  -3.183   1.915  14.649
  145   1H5*    A  14          1H5*        A  14  -7.507  -0.434   6.966
  146   2H5*    A  14          2H5*        A  14  -6.512   0.243   8.274
  147    H4*    A  14           H4*        A  14  -9.559   0.321   8.057
  148    H3*    A  14           H3*        A  14  -7.388   2.374   7.643
  149    H2*    A  14           H2*        A  14  -8.726   4.058   8.656
  150   2HO*    A  14          2HO*        A  14 -10.779   3.288   7.786
  151    H1*    A  14           H1*        A  14  -9.320   2.643  10.852
  152    H8     A  14           H8         A  14  -6.172   0.908  10.373
  153   1H6     A  14          1H6         A  14  -3.170   6.075  11.991
  154   2H6     A  14          2H6         A  14  -3.004   4.349  11.651
  155    H2     A  14           H2         A  14  -7.366   7.174  11.084
  156   1H5*    A  15          1H5*        A  15  -9.733   5.867   7.177
  157   2H5*    A  15          2H5*        A  15  -9.533   6.315   5.478
  158    H4*    A  15           H4*        A  15  -8.468   7.935   6.909
  159    H3*    A  15           H3*        A  15  -6.477   6.252   5.372
  160    H2*    A  15           H2*        A  15  -4.802   7.784   6.228
  161   2HO*    A  15          2HO*        A  15  -6.416   9.603   6.018
  162    H1*    A  15           H1*        A  15  -5.767   7.788   8.786
  163    H8     A  15           H8         A  15  -6.266   4.282   7.581
  164   1H6     A  15          1H6         A  15  -0.136   3.527   8.517
  165   2H6     A  15          2H6         A  15  -1.615   2.660   8.072
  166    H2     A  15           H2         A  15  -1.060   7.760   9.044
  167   1H5*    G  16          1H5*        G  16  -5.352  10.351   4.606
  168   2H5*    G  16          2H5*        G  16  -4.832  10.496   2.919
  169    H4*    G  16           H4*        G  16  -3.082  11.167   4.573
  170    H3*    G  16           H3*        G  16  -2.503   8.809   2.768
  171    H2*    G  16           H2*        G  16  -0.248   8.868   3.654
  172   2HO*    G  16          2HO*        G  16  -0.372  11.293   3.763
  173    H1*    G  16           H1*        G  16  -1.039   9.117   6.253
  174    H8     G  16           H8         G  16  -3.592   6.796   4.691
  175    H1     G  16           H1         G  16   2.116   4.016   5.735
  176   1H2     G  16          1H2         G  16   3.612   5.432   5.891
  177   2H2     G  16          2H2         G  16   3.435   7.124   5.901
  178   1H5*    C  17          1H5*        C  17   0.811  11.654   2.391
  179   2H5*    C  17          2H5*        C  17   1.256  11.781   0.681
  180    H4*    C  17           H4*        C  17   3.180  11.205   2.165
  181    H3*    C  17           H3*        C  17   2.339   9.190   0.067
  182    H2*    C  17           H2*        C  17   4.329   7.959   0.649
  183   2HO*    C  17          2HO*        C  17   5.464  10.113   0.977
  184    H1*    C  17           H1*        C  17   4.028   8.308   3.364
  185   1H4     C  17          2H4         C  17   1.674   2.556   2.397
  186   2H4     C  17          1H4         C  17   0.048   3.204   2.220
  187    H5     C  17           H5         C  17  -0.354   5.640   1.934
  188    H6     C  17           H6         C  17   0.698   7.814   2.007
  189   1H5*    C  18          1H5*        C  18   6.657   9.824  -0.539
  190   2H5*    C  18          2H5*        C  18   6.889  10.041  -2.283
  191    H4*    C  18           H4*        C  18   8.328   8.235  -1.465
  192    H3*    C  18           H3*        C  18   5.986   7.269  -3.160
  193    H2*    C  18           H2*        C  18   7.029   5.127  -3.133
  194   2HO*    C  18          2HO*        C  18   9.205   6.219  -3.297
  195    H1*    C  18           H1*        C  18   7.723   5.283  -0.442
  196   1H4     C  18          2H4         C  18   2.431   1.857  -0.569
  197   2H4     C  18          1H4         C  18   1.397   3.282  -0.675
  198    H5     C  18           H5         C  18   2.367   5.550  -1.015
  199    H6     C  18           H6         C  18   4.438   6.783  -1.185
  200    H3T    C  18           H3T        C  18   7.424   8.645  -4.246
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1   5.619  -7.392   0.481
    2   2H5*    G   1          2H5*        G   1   6.701  -7.561   1.871
    3    H4*    G   1           H4*        G   1   8.068  -6.587   0.258
    4    H3*    G   1           H3*        G   1   6.946  -4.304   1.920
    5    H2*    G   1           H2*        G   1   8.405  -2.857   0.773
    6   2HO*    G   1          2HO*        G   1  10.105  -4.570   0.651
    7    H1*    G   1           H1*        G   1   7.700  -3.800  -1.676
    8    H8     G   1           H8         G   1   4.413  -4.373  -0.243
    9    H1     G   1           H1         G   1   5.633   1.928  -0.649
   10   1H2     G   1          2H2         G   1   7.846   2.256  -0.727
   11   2H2     G   1          1H2         G   1   8.965   0.895  -0.822
   12    H5T    G   1           H5T        G   1   5.765  -5.809   2.843
   13   1H5*    G   2          1H5*        G   2  10.703  -3.768   3.200
   14   2H5*    G   2          2H5*        G   2  10.739  -3.511   4.951
   15    H4*    G   2           H4*        G   2  11.445  -1.523   3.661
   16    H3*    G   2           H3*        G   2   8.874  -1.230   5.231
   17    H2*    G   2           H2*        G   2   8.961   1.104   4.629
   18   2HO*    G   2          2HO*        G   2  11.387   1.049   4.831
   19    H1*    G   2           H1*        G   2   9.602   0.661   2.015
   20    H8     G   2           H8         G   2   7.124  -2.041   2.784
   21    H1     G   2           H1         G   2   4.482   3.833   2.669
   22   1H2     G   2          2H2         G   2   6.133   5.378   2.767
   23   2H2     G   2          1H2         G   2   7.823   4.874   2.701
   24   1H5*    C   3          1H5*        C   3  11.430   2.119   6.354
   25   2H5*    C   3          2H5*        C   3  11.306   2.378   8.101
   26    H4*    C   3           H4*        C   3  10.768   4.407   6.731
   27    H3*    C   3           H3*        C   3   8.588   3.255   8.493
   28    H2*    C   3           H2*        C   3   7.324   5.225   7.930
   29   2HO*    C   3          2HO*        C   3   9.411   6.504   7.964
   30    H1*    C   3           H1*        C   3   7.965   5.183   5.268
   31   1H4     C   3          2H4         C   3   2.261   2.358   5.634
   32   2H4     C   3          1H4         C   3   3.077   0.818   5.739
   33    H5     C   3           H5         C   3   5.467   0.551   6.041
   34    H6     C   3           H6         C   3   7.574   1.713   6.169
   35   1H5*    U   4          1H5*        U   4   8.166   7.169   9.600
   36   2H5*    U   4          2H5*        U   4   7.973   7.272  11.359
   37    H4*    U   4           H4*        U   4   5.973   8.092  10.167
   38    H3*    U   4           H3*        U   4   5.579   5.530  11.735
   39    H2*    U   4           H2*        U   4   3.218   5.790  11.245
   40   2HO*    U   4          2HO*        U   4   3.371   8.172  11.431
   41    H1*    U   4           H1*        U   4   3.619   6.380   8.608
   42    H3     U   4           H3         U   4   1.813   2.163   8.936
   43    H5     U   4           H5         U   4   5.941   1.608   9.453
   44    H6     U   4           H6         U   4   6.221   4.002   9.518
   45   1H5*    A   5          1H5*        A   5   2.515   8.417  12.992
   46   2H5*    A   5          2H5*        A   5   2.185   8.194  14.716
   47    H4*    A   5           H4*        A   5   0.157   7.967  13.303
   48    H3*    A   5           H3*        A   5   1.032   5.451  14.753
   49    H2*    A   5           H2*        A   5  -1.106   4.548  14.077
   50   2HO*    A   5          2HO*        A   5  -2.275   6.587  14.350
   51    H1*    A   5           H1*        A   5  -0.834   5.400  11.484
   52    H8     A   5           H8         A   5   2.593   4.440  12.889
   53   1H6     A   5          1H6         A   5   1.093  -1.398  11.391
   54   2H6     A   5          2H6         A   5   2.431  -0.343  11.838
   55    H2     A   5           H2         A   5  -2.523   1.052  10.942
   56   1H5*    A   6          1H5*        A   6  -2.417   8.420  15.889
   57   2H5*    A   6          2H5*        A   6  -2.974   8.108  17.545
   58    H4*    A   6           H4*        A   6  -4.787   8.828  15.971
   59    H3*    A   6           H3*        A   6  -5.014   6.081  17.228
   60    H2*    A   6           H2*        A   6  -7.213   5.987  16.221
   61   2HO*    A   6          2HO*        A   6  -7.454   8.383  16.629
   62    H1*    A   6           H1*        A   6  -6.392   6.860  13.777
   63    H8     A   6           H8         A   6  -3.514   4.746  14.980
   64   1H6     A   6          1H6         A   6  -6.915  -0.125  13.193
   65   2H6     A   6          2H6         A   6  -5.314   0.369  13.733
   66    H2     A   6           H2         A   6  -9.570   3.384  13.287
   67   1H5*    G   7          1H5*        G   7  -8.708   6.776  18.006
   68   2H5*    G   7          2H5*        G   7  -9.116   6.319  19.671
   69    H4*    G   7           H4*        G   7 -10.234   4.888  17.976
   70    H3*    G   7           H3*        G   7  -8.216   3.499  19.757
   71    H2*    G   7           H2*        G   7  -8.958   1.433  18.715
   72   2HO*    G   7          2HO*        G   7 -11.217   2.373  18.554
   73    H1*    G   7           H1*        G   7  -8.821   2.400  16.182
   74    H8     G   7           H8         G   7  -5.935   4.085  17.959
   75    H1     G   7           H1         G   7  -4.914  -2.164  16.820
   76   1H2     G   7          2H2         G   7  -6.816  -3.126  16.181
   77   2H2     G   7          1H2         G   7  -8.291  -2.176  15.964
   78   1H5*    A   8          1H5*        A   8 -11.792   1.120  19.786
   79   2H5*    A   8          2H5*        A   8 -12.099   0.458  21.396
   80    H4*    A   8           H4*        A   8 -11.883  -1.254  19.548
   81    H3*    A   8           H3*        A   8 -10.013  -1.359  21.922
   82    H2*    A   8           H2*        A   8  -9.209  -3.462  21.021
   83   2HO*    A   8          2HO*        A   8 -11.507  -3.915  20.267
   84    H1*    A   8           H1*        A   8  -9.016  -2.565  18.444
   85    H8     A   8           H8         A   8  -7.867   0.424  20.395
   86   1H6     A   8          1H6         A   8  -2.325  -2.435  20.409
   87   2H6     A   8          2H6         A   8  -3.146  -0.894  20.621
   88    H2     A   8           H2         A   8  -5.408  -5.435  19.387
   89   1H5*    C   9          1H5*        C   9 -11.713  -5.305  21.671
   90   2H5*    C   9          2H5*        C   9 -12.146  -5.872  23.297
   91    H4*    C   9           H4*        C   9 -10.519  -7.392  22.197
   92    H3*    C   9           H3*        C   9  -9.479  -5.839  24.595
   93    H2*    C   9           H2*        C   9  -7.479  -7.114  24.443
   94   2HO*    C   9          2HO*        C   9  -7.325  -8.895  22.992
   95    H1*    C   9           H1*        C   9  -7.361  -6.997  21.661
   96   1H4     C   9          2H4         C   9  -3.351  -2.542  23.524
   97   2H4     C   9          1H4         C   9  -4.635  -1.350  23.736
   98    H5     C   9           H5         C   9  -7.027  -1.993  23.570
   99    H6     C   9           H6         C   9  -8.525  -3.812  23.066
  100    H3T    C   9           H3T        C   9  -9.984  -8.590  24.408
  101   1H5*    G  10          1H5*        G  10   6.362  -6.288  22.456
  102   2H5*    G  10          2H5*        G  10   6.549  -7.481  21.163
  103    H4*    G  10           H4*        G  10   5.279  -8.639  22.719
  104    H3*    G  10           H3*        G  10   3.289  -7.357  20.815
  105    H2*    G  10           H2*        G  10   1.574  -8.513  21.912
  106   2HO*    G  10          2HO*        G  10   3.040 -10.424  22.227
  107    H1*    G  10           H1*        G  10   2.459  -7.901  24.417
  108    H8     G  10           H8         G  10   3.428  -4.686  23.134
  109    H1     G  10           H1         G  10  -2.975  -5.295  23.058
  110   1H2     G  10          2H2         G  10  -3.510  -7.466  22.959
  111   2H2     G  10          1H2         G  10  -2.273  -8.717  23.100
  112    H5T    G  10           H5T        G  10   5.023  -6.453  19.951
  113   1H5*    U  11          1H5*        U  11   2.323 -11.061  19.666
  114   2H5*    U  11          2H5*        U  11   2.269 -11.186  17.900
  115    H4*    U  11           H4*        U  11   0.044 -11.462  18.891
  116    H3*    U  11           H3*        U  11   0.423  -8.909  17.310
  117    H2*    U  11           H2*        U  11  -1.938  -8.540  17.626
  118   2HO*    U  11          2HO*        U  11  -2.378 -10.887  17.390
  119    H1*    U  11           H1*        U  11  -1.961  -9.209  20.253
  120    H3     U  11           H3         U  11  -2.641  -4.703  19.831
  121    H5     U  11           H5         U  11   1.536  -5.179  19.899
  122    H6     U  11           H6         U  11   1.220  -7.573  19.769
  123   1H5*    C  12          1H5*        C  12  -3.172 -10.874  15.680
  124   2H5*    C  12          2H5*        C  12  -3.236 -10.556  13.939
  125    H4*    C  12           H4*        C  12  -5.244  -9.736  15.245
  126    H3*    C  12           H3*        C  12  -3.575  -7.738  13.709
  127    H2*    C  12           H2*        C  12  -5.219  -6.106  14.261
  128   2HO*    C  12          2HO*        C  12  -7.185  -6.583  15.168
  129    H1*    C  12           H1*        C  12  -5.555  -6.989  16.879
  130   1H4     C  12          2H4         C  12  -2.043  -1.832  17.248
  131   2H4     C  12          1H4         C  12  -0.534  -2.745  17.150
  132    H5     C  12           H5         C  12  -0.556  -5.180  16.567
  133    H6     C  12           H6         C  12  -2.009  -7.078  16.170
  134   1H5*    G  13          1H5*        G  13  -7.356  -6.503  12.536
  135   2H5*    G  13          2H5*        G  13  -7.339  -6.211  10.791
  136    H4*    G  13           H4*        G  13  -7.915  -4.169  11.996
  137    H3*    G  13           H3*        G  13  -5.207  -4.114  10.647
  138    H2*    G  13           H2*        G  13  -5.128  -1.771  11.188
  139   2HO*    G  13          2HO*        G  13  -7.438  -1.436  10.778
  140    H1*    G  13           H1*        G  13  -5.937  -2.121  13.781
  141    H8     G  13           H8         G  13  -3.825  -5.087  12.582
  142    H1     G  13           H1         G  13  -0.318  -0.141  14.689
  143   1H2     G  13          2H2         G  13  -1.614   1.624  15.070
  144   2H2     G  13          1H2         G  13  -3.321   1.602  14.720
  145   1H5*    A  14          1H5*        A  14  -9.176  -1.968   9.138
  146   2H5*    A  14          2H5*        A  14  -8.939  -1.579   7.423
  147    H4*    A  14           H4*        A  14 -10.307   0.106   8.652
  148    H3*    A  14           H3*        A  14  -7.692   0.995   7.431
  149    H2*    A  14           H2*        A  14  -8.207   3.219   8.137
  150   2HO*    A  14          2HO*        A  14 -10.459   3.042   7.508
  151    H1*    A  14           H1*        A  14  -9.226   2.530  10.602
  152    H8     A  14           H8         A  14  -6.165   0.390  10.127
  153   1H6     A  14          1H6         A  14  -3.051   5.499  11.932
  154   2H6     A  14          2H6         A  14  -2.864   3.775  11.606
  155    H2     A  14           H2         A  14  -7.127   6.689  10.829
  156   1H5*    A  15          1H5*        A  15  -7.840   4.334   4.096
  157   2H5*    A  15          2H5*        A  15  -6.892   3.721   5.457
  158    H4*    A  15           H4*        A  15  -8.765   6.127   5.618
  159    H3*    A  15           H3*        A  15  -5.848   5.827   4.933
  160    H2*    A  15           H2*        A  15  -5.249   7.719   6.259
  161   2HO*    A  15          2HO*        A  15  -7.424   8.721   5.592
  162    H1*    A  15           H1*        A  15  -6.679   7.022   8.445
  163    H8     A  15           H8         A  15  -5.981   3.616   7.449
  164   1H6     A  15          1H6         A  15  -0.003   4.451   8.919
  165   2H6     A  15          2H6         A  15  -1.220   3.250   8.466
  166    H2     A  15           H2         A  15  -1.992   8.373   9.084
  167   1H5*    G  16          1H5*        G  16  -5.609   9.710   4.608
  168   2H5*    G  16          2H5*        G  16  -5.020  10.173   3.000
  169    H4*    G  16           H4*        G  16  -3.508  10.956   4.778
  170    H3*    G  16           H3*        G  16  -2.433   8.830   2.914
  171    H2*    G  16           H2*        G  16  -0.298   9.088   4.012
  172   2HO*    G  16          2HO*        G  16  -0.782  11.481   4.242
  173    H1*    G  16           H1*        G  16  -1.307   9.075   6.543
  174    H8     G  16           H8         G  16  -3.550   6.605   4.873
  175    H1     G  16           H1         G  16   2.366   4.302   5.908
  176   1H2     G  16          1H2         G  16   3.736   5.815   6.109
  177   2H2     G  16          2H2         G  16   3.441   7.489   6.154
  178   1H5*    C  17          1H5*        C  17   0.561  11.951   2.963
  179   2H5*    C  17          2H5*        C  17   1.083  12.265   1.299
  180    H4*    C  17           H4*        C  17   2.972  11.693   2.817
  181    H3*    C  17           H3*        C  17   2.362   9.789   0.542
  182    H2*    C  17           H2*        C  17   4.391   8.633   1.137
  183   2HO*    C  17          2HO*        C  17   5.376  10.820   1.674
  184    H1*    C  17           H1*        C  17   3.945   8.768   3.852
  185   1H4     C  17          2H4         C  17   1.966   2.976   2.472
  186   2H4     C  17          1H4         C  17   0.314   3.542   2.241
  187    H5     C  17           H5         C  17  -0.209   5.967   2.059
  188    H6     C  17           H6         C  17   0.716   8.186   2.294
  189   1H5*    C  18          1H5*        C  18   6.661  10.700   0.197
  190   2H5*    C  18          2H5*        C  18   6.954  11.056  -1.515
  191    H4*    C  18           H4*        C  18   8.455   9.273  -0.769
  192    H3*    C  18           H3*        C  18   6.235   8.307  -2.620
  193    H2*    C  18           H2*        C  18   7.388   6.226  -2.695
  194   2HO*    C  18          2HO*        C  18   9.507   7.439  -2.699
  195    H1*    C  18           H1*        C  18   7.981   6.232   0.025
  196   1H4     C  18          2H4         C  18   2.893   2.545  -0.507
  197   2H4     C  18          1H4         C  18   1.787   3.917  -0.580
  198    H5     C  18           H5         C  18   2.641   6.249  -0.750
  199    H6     C  18           H6         C  18   4.646   7.599  -0.764
  200    H3T    C  18           H3T        C  18   7.634   9.830  -3.549
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1   7.172  -8.845   0.231
    2   2H5*    G   1          2H5*        G   1   7.396  -8.605   1.974
    3    H4*    G   1           H4*        G   1   8.796  -7.080   0.601
    4    H3*    G   1           H3*        G   1   6.646  -5.713   2.249
    5    H2*    G   1           H2*        G   1   7.804  -3.668   1.663
    6   2HO*    G   1          2HO*        G   1   9.936  -4.691   1.838
    7    H1*    G   1           H1*        G   1   8.111  -4.399  -0.978
    8    H8     G   1           H8         G   1   4.640  -5.517  -0.005
    9    H1     G   1           H1         G   1   5.117   0.862  -0.699
   10   1H2     G   1          2H2         G   1   7.285   1.443  -0.763
   11   2H2     G   1          1H2         G   1   8.552   0.216  -0.709
   12    H5T    G   1           H5T        G   1   5.278  -7.570   0.392
   13   1H5*    G   2          1H5*        G   2  10.571  -4.073   3.478
   14   2H5*    G   2          2H5*        G   2  10.480  -3.645   5.193
   15    H4*    G   2           H4*        G   2  11.134  -1.755   3.666
   16    H3*    G   2           H3*        G   2   8.616  -1.463   5.319
   17    H2*    G   2           H2*        G   2   8.568   0.833   4.543
   18   2HO*    G   2          2HO*        G   2  10.987   0.913   4.618
   19    H1*    G   2           H1*        G   2   9.076   0.195   1.943
   20    H8     G   2           H8         G   2   6.778  -2.543   3.227
   21    H1     G   2           H1         G   2   3.817   3.096   2.324
   22   1H2     G   2          2H2         G   2   5.380   4.733   2.176
   23   2H2     G   2          1H2         G   2   7.094   4.320   2.152
   24   1H5*    C   3          1H5*        C   3  11.060   2.089   6.098
   25   2H5*    C   3          2H5*        C   3  10.916   2.525   7.809
   26    H4*    C   3           H4*        C   3  10.275   4.362   6.228
   27    H3*    C   3           H3*        C   3   8.122   3.307   8.086
   28    H2*    C   3           H2*        C   3   6.801   5.159   7.291
   29   2HO*    C   3          2HO*        C   3   8.812   6.528   7.193
   30    H1*    C   3           H1*        C   3   7.454   4.808   4.658
   31   1H4     C   3          2H4         C   3   1.902   1.881   5.512
   32   2H4     C   3          1H4         C   3   2.730   0.352   5.781
   33    H5     C   3           H5         C   3   5.164   0.223   6.155
   34    H6     C   3           H6         C   3   7.216   1.486   6.089
   35   1H5*    U   4          1H5*        U   4   7.459   7.280   8.731
   36   2H5*    U   4          2H5*        U   4   7.174   7.580  10.453
   37    H4*    U   4           H4*        U   4   5.202   8.120   9.060
   38    H3*    U   4           H3*        U   4   4.799   5.699  10.821
   39    H2*    U   4           H2*        U   4   2.435   5.931  10.284
   40   2HO*    U   4          2HO*        U   4   2.954   8.453   9.656
   41    H1*    U   4           H1*        U   4   3.029   5.951   7.654
   42    H3     U   4           H3         U   4   1.489   1.788   8.919
   43    H5     U   4           H5         U   4   5.655   1.637   9.394
   44    H6     U   4           H6         U   4   5.753   4.008   8.992
   45   1H5*    A   5          1H5*        A   5   1.266   9.667  10.748
   46   2H5*    A   5          2H5*        A   5   1.190  10.228  12.431
   47    H4*    A   5           H4*        A   5  -0.954   9.262  11.672
   48    H3*    A   5           H3*        A   5   0.484   7.617  13.775
   49    H2*    A   5           H2*        A   5  -1.509   6.280  13.877
   50   2HO*    A   5          2HO*        A   5  -3.008   8.056  13.681
   51    H1*    A   5           H1*        A   5  -1.803   6.170  11.129
   52    H8     A   5           H8         A   5   1.803   6.024  12.562
   53   1H6     A   5          1H6         A   5   1.103  -0.127  11.988
   54   2H6     A   5          2H6         A   5   2.271   1.150  12.303
   55    H2     A   5           H2         A   5  -2.796   1.740  11.171
   56   1H5*    A   6          1H5*        A   6  -3.600   8.328  17.415
   57   2H5*    A   6          2H5*        A   6  -3.347   6.869  16.429
   58    H4*    A   6           H4*        A   6  -5.456   9.016  15.896
   59    H3*    A   6           H3*        A   6  -5.625   6.284  17.203
   60    H2*    A   6           H2*        A   6  -7.866   6.119  16.316
   61   2HO*    A   6          2HO*        A   6  -8.126   8.531  16.612
   62    H1*    A   6           H1*        A   6  -7.119   6.827  13.806
   63    H8     A   6           H8         A   6  -4.008   5.113  14.843
   64   1H6     A   6          1H6         A   6  -7.012  -0.228  13.811
   65   2H6     A   6          2H6         A   6  -5.422   0.464  14.113
   66    H2     A   6           H2         A   6 -10.021   2.969  14.038
   67   1H5*    G   7          1H5*        G   7  -8.884   6.706  18.525
   68   2H5*    G   7          2H5*        G   7  -9.055   6.261  20.234
   69    H4*    G   7           H4*        G   7 -10.128   4.648  18.658
   70    H3*    G   7           H3*        G   7  -7.809   3.566  20.282
   71    H2*    G   7           H2*        G   7  -8.435   1.398  19.370
   72   2HO*    G   7          2HO*        G   7 -10.780   2.070  19.406
   73    H1*    G   7           H1*        G   7  -8.634   2.305  16.815
   74    H8     G   7           H8         G   7  -5.770   4.291  18.275
   75    H1     G   7           H1         G   7  -4.280  -1.882  17.212
   76   1H2     G   7          2H2         G   7  -6.136  -3.034  16.771
   77   2H2     G   7          1H2         G   7  -7.701  -2.225  16.666
   78   1H5*    A   8          1H5*        A   8 -11.162   0.905  20.742
   79   2H5*    A   8          2H5*        A   8 -11.242   0.231  22.374
   80    H4*    A   8           H4*        A   8 -11.096  -1.455  20.482
   81    H3*    A   8           H3*        A   8  -9.041  -1.459  22.697
   82    H2*    A   8           H2*        A   8  -8.166  -3.503  21.692
   83   2HO*    A   8          2HO*        A   8 -10.516  -4.033  21.066
   84    H1*    A   8           H1*        A   8  -8.214  -2.552  19.137
   85    H8     A   8           H8         A   8  -7.172   0.546  20.929
   86   1H6     A   8          1H6         A   8  -1.434  -1.847  20.545
   87   2H6     A   8          2H6         A   8  -2.366  -0.372  20.755
   88    H2     A   8           H2         A   8  -4.334  -5.142  19.946
   89   1H5*    C   9          1H5*        C   9 -10.493  -5.367  22.400
   90   2H5*    C   9          2H5*        C   9 -10.931  -6.100  23.949
   91    H4*    C   9           H4*        C   9  -9.215  -7.385  22.607
   92    H3*    C   9           H3*        C   9  -9.267  -7.074  25.371
   93    H2*    C   9           H2*        C   9  -7.688  -5.302  25.423
   94   2HO*    C   9          2HO*        C   9  -5.628  -6.262  25.974
   95    H1*    C   9           H1*        C   9  -6.133  -6.795  23.282
   96   1H4     C   9          2H4         C   9  -2.444  -1.673  23.670
   97   2H4     C   9          1H4         C   9  -3.798  -0.552  23.845
   98    H5     C   9           H5         C   9  -6.140  -1.376  23.967
   99    H6     C   9           H6         C   9  -7.523  -3.355  23.837
  100    H3T    C   9           H3T        C   9  -7.319  -8.576  25.092
  101   1H5*    G  10          1H5*        G  10   7.489  -4.828  22.580
  102   2H5*    G  10          2H5*        G  10   7.754  -6.057  21.335
  103    H4*    G  10           H4*        G  10   6.587  -7.237  22.957
  104    H3*    G  10           H3*        G  10   4.492  -6.200  21.018
  105    H2*    G  10           H2*        G  10   2.877  -7.431  22.193
  106   2HO*    G  10          2HO*        G  10   4.479  -9.210  22.578
  107    H1*    G  10           H1*        G  10   3.731  -6.629  24.650
  108    H8     G  10           H8         G  10   4.448  -3.431  23.123
  109    H1     G  10           H1         G  10  -1.894  -4.487  23.404
  110   1H2     G  10          2H2         G  10  -2.272  -6.692  23.505
  111   2H2     G  10          1H2         G  10  -0.940  -7.843  23.625
  112    H5T    G  10           H5T        G  10   6.150  -5.198  20.098
  113   1H5*    U  11          1H5*        U  11   3.876 -10.051  19.961
  114   2H5*    U  11          2H5*        U  11   3.783 -10.206  18.199
  115    H4*    U  11           H4*        U  11   1.616 -10.643  19.264
  116    H3*    U  11           H3*        U  11   1.730  -8.088  17.642
  117    H2*    U  11           H2*        U  11  -0.653  -7.937  18.020
  118   2HO*    U  11          2HO*        U  11  -0.891 -10.311  17.842
  119    H1*    U  11           H1*        U  11  -0.522  -8.535  20.658
  120    H3     U  11           H3         U  11  -1.590  -4.117  20.126
  121    H5     U  11           H5         U  11   2.611  -4.235  19.992
  122    H6     U  11           H6         U  11   2.495  -6.651  19.989
  123   1H5*    C  12          1H5*        C  12  -1.722 -10.430  16.172
  124   2H5*    C  12          2H5*        C  12  -1.857 -10.170  14.425
  125    H4*    C  12           H4*        C  12  -3.920  -9.568  15.726
  126    H3*    C  12           H3*        C  12  -2.529  -7.391  14.145
  127    H2*    C  12           H2*        C  12  -4.408  -5.989  14.702
  128   2HO*    C  12          2HO*        C  12  -5.863  -7.935  14.468
  129    H1*    C  12           H1*        C  12  -4.570  -6.822  17.325
  130   1H4     C  12          2H4         C  12  -1.499  -1.338  17.455
  131   2H4     C  12          1H4         C  12   0.076  -2.122  17.304
  132    H5     C  12           H5         C  12   0.247  -4.560  16.797
  133    H6     C  12           H6         C  12  -1.038  -6.588  16.514
  134   1H5*    G  13          1H5*        G  13  -6.494  -6.698  12.922
  135   2H5*    G  13          2H5*        G  13  -6.477  -6.442  11.172
  136    H4*    G  13           H4*        G  13  -7.338  -4.465  12.359
  137    H3*    G  13           H3*        G  13  -4.587  -4.023  11.181
  138    H2*    G  13           H2*        G  13  -4.937  -1.691  11.564
  139   2HO*    G  13          2HO*        G  13  -7.404  -1.910  11.260
  140    H1*    G  13           H1*        G  13  -5.660  -2.181  14.153
  141    H8     G  13           H8         G  13  -3.186  -4.874  13.068
  142    H1     G  13           H1         G  13  -0.318   0.609  14.751
  143   1H2     G  13          1H2         G  13  -1.818   2.205  15.057
  144   2H2     G  13          2H2         G  13  -3.520   1.949  14.774
  145   1H5*    A  14          1H5*        A  14  -8.354  -1.571   7.878
  146   2H5*    A  14          2H5*        A  14  -7.097  -0.928   8.967
  147    H4*    A  14           H4*        A  14 -10.111  -0.634   9.365
  148    H3*    A  14           H3*        A  14  -8.095   1.312   8.213
  149    H2*    A  14           H2*        A  14  -9.399   3.075   9.179
  150   2HO*    A  14          2HO*        A  14 -11.510   2.010   8.864
  151    H1*    A  14           H1*        A  14  -9.495   1.927  11.613
  152    H8     A  14           H8         A  14  -6.239   0.547  10.926
  153   1H6     A  14          1H6         A  14  -3.923   6.263  11.773
  154   2H6     A  14          2H6         A  14  -3.495   4.553  11.660
  155    H2     A  14           H2         A  14  -8.222   6.642  10.897
  156   1H5*    A  15          1H5*        A  15  -9.038   3.653   4.903
  157   2H5*    A  15          2H5*        A  15  -7.980   3.073   6.211
  158    H4*    A  15           H4*        A  15  -9.344   5.811   6.134
  159    H3*    A  15           H3*        A  15  -6.610   4.902   5.236
  160    H2*    A  15           H2*        A  15  -5.672   6.968   6.041
  161   2HO*    A  15          2HO*        A  15  -7.797   8.070   5.406
  162    H1*    A  15           H1*        A  15  -6.864   6.868   8.470
  163    H8     A  15           H8         A  15  -6.628   3.266   8.036
  164   1H6     A  15          1H6         A  15  -0.425   3.712   8.370
  165   2H6     A  15          2H6         A  15  -1.760   2.555   8.232
  166    H2     A  15           H2         A  15  -2.055   7.769   8.347
  167   1H5*    G  16          1H5*        G  16  -6.405   8.790   4.038
  168   2H5*    G  16          2H5*        G  16  -5.916   8.902   2.339
  169    H4*    G  16           H4*        G  16  -4.399  10.130   3.885
  170    H3*    G  16           H3*        G  16  -3.263   7.804   2.320
  171    H2*    G  16           H2*        G  16  -1.094   8.449   3.175
  172   2HO*    G  16          2HO*        G  16  -1.818  10.792   3.048
  173    H1*    G  16           H1*        G  16  -1.942   8.778   5.747
  174    H8     G  16           H8         G  16  -3.969   5.823   4.686
  175    H1     G  16           H1         G  16   2.275   4.413   5.385
  176   1H2     G  16          2H2         G  16   3.483   6.318   5.315
  177   2H2     G  16          1H2         G  16   2.666   7.880   5.310
  178   1H5*    C  17          1H5*        C  17  -0.526  11.021   1.611
  179   2H5*    C  17          2H5*        C  17  -0.151  11.087  -0.120
  180    H4*    C  17           H4*        C  17   1.880  10.869   1.295
  181    H3*    C  17           H3*        C  17   1.222   8.569  -0.562
  182    H2*    C  17           H2*        C  17   3.375   7.660   0.032
  183   2HO*    C  17          2HO*        C  17   4.266   9.929   0.100
  184    H1*    C  17           H1*        C  17   3.119   8.207   2.714
  185   1H4     C  17          2H4         C  17   1.413   2.156   2.256
  186   2H4     C  17          1H4         C  17  -0.277   2.605   2.058
  187    H5     C  17           H5         C  17  -0.965   4.952   1.650
  188    H6     C  17           H6         C  17  -0.174   7.228   1.544
  189   1H5*    C  18          1H5*        C  18   5.378   9.811  -1.445
  190   2H5*    C  18          2H5*        C  18   5.583   9.760  -3.206
  191    H4*    C  18           H4*        C  18   7.262   8.355  -2.021
  192    H3*    C  18           H3*        C  18   5.235   6.899  -3.757
  193    H2*    C  18           H2*        C  18   6.469   4.909  -3.360
  194   2HO*    C  18          2HO*        C  18   8.528   4.961  -2.356
  195    H1*    C  18           H1*        C  18   7.009   5.507  -0.669
  196   1H4     C  18          2H4         C  18   2.394   1.214  -0.609
  197   2H4     C  18          1H4         C  18   1.147   2.434  -0.855
  198    H5     C  18           H5         C  18   1.733   4.787  -1.408
  199    H6     C  18           H6         C  18   3.573   6.335  -1.670
  200    H3T    C  18           H3T        C  18   7.972   7.241  -4.236
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1   5.929  -8.327   1.058
    2   2H5*    G   1          2H5*        G   1   6.574  -8.166   2.699
    3    H4*    G   1           H4*        G   1   8.125  -7.118   1.202
    4    H3*    G   1           H3*        G   1   6.471  -5.053   2.682
    5    H2*    G   1           H2*        G   1   7.933  -3.398   1.756
    6   2HO*    G   1          2HO*        G   1   9.815  -4.904   1.931
    7    H1*    G   1           H1*        G   1   7.784  -4.410  -0.773
    8    H8     G   1           H8         G   1   4.347  -5.171   0.420
    9    H1     G   1           H1         G   1   5.237   1.140  -0.474
   10   1H2     G   1          2H2         G   1   7.435   1.568  -0.607
   11   2H2     G   1          1H2         G   1   8.621   0.262  -0.548
   12    H5T    G   1           H5T        G   1   5.104  -6.532   3.101
   13   1H5*    G   2          1H5*        G   2  10.397  -3.909   3.627
   14   2H5*    G   2          2H5*        G   2  10.489  -3.461   5.339
   15    H4*    G   2           H4*        G   2  11.199  -1.636   3.810
   16    H3*    G   2           H3*        G   2   8.730  -1.140   5.490
   17    H2*    G   2           H2*        G   2   8.799   1.129   4.664
   18   2HO*    G   2          2HO*        G   2  11.238   1.037   4.697
   19    H1*    G   2           H1*        G   2   9.229   0.426   2.071
   20    H8     G   2           H8         G   2   6.842  -2.194   3.369
   21    H1     G   2           H1         G   2   4.120   3.587   2.617
   22   1H2     G   2          2H2         G   2   5.735   5.148   2.520
   23   2H2     G   2          1H2         G   2   7.434   4.678   2.426
   24   1H5*    C   3          1H5*        C   3  11.256   2.319   6.107
   25   2H5*    C   3          2H5*        C   3  11.245   2.738   7.827
   26    H4*    C   3           H4*        C   3  10.557   4.618   6.327
   27    H3*    C   3           H3*        C   3   8.520   3.580   8.319
   28    H2*    C   3           H2*        C   3   7.174   5.463   7.662
   29   2HO*    C   3          2HO*        C   3   9.221   6.787   7.458
   30    H1*    C   3           H1*        C   3   7.664   5.204   4.979
   31   1H4     C   3          2H4         C   3   2.057   2.325   5.800
   32   2H4     C   3          1H4         C   3   2.908   0.811   5.987
   33    H5     C   3           H5         C   3   5.310   0.614   6.249
   34    H6     C   3           H6         C   3   7.395   1.821   6.202
   35   1H5*    U   4          1H5*        U   4   8.049   7.580   9.079
   36   2H5*    U   4          2H5*        U   4   7.944   7.844  10.829
   37    H4*    U   4           H4*        U   4   5.859   8.496   9.668
   38    H3*    U   4           H3*        U   4   5.634   6.102  11.509
   39    H2*    U   4           H2*        U   4   3.250   6.220  11.121
   40   2HO*    U   4          2HO*        U   4   3.203   8.573  11.084
   41    H1*    U   4           H1*        U   4   3.485   6.576   8.421
   42    H3     U   4           H3         U   4   1.843   2.350   9.159
   43    H5     U   4           H5         U   4   6.003   1.968   9.552
   44    H6     U   4           H6         U   4   6.203   4.367   9.416
   45   1H5*    A   5          1H5*        A   5   2.590   9.135  12.609
   46   2H5*    A   5          2H5*        A   5   2.291   9.069  14.352
   47    H4*    A   5           H4*        A   5   0.243   8.669  12.936
   48    H3*    A   5           H3*        A   5   1.169   6.311  14.594
   49    H2*    A   5           H2*        A   5  -0.983   5.350  14.151
   50   2HO*    A   5          2HO*        A   5  -2.128   7.512  14.043
   51    H1*    A   5           H1*        A   5  -0.689   5.867  11.476
   52    H8     A   5           H8         A   5   2.734   5.134  13.086
   53   1H6     A   5          1H6         A   5   1.449  -0.820  11.836
   54   2H6     A   5          2H6         A   5   2.717   0.283  12.363
   55    H2     A   5           H2         A   5  -2.165   1.519  10.995
   56   1H5*    A   6          1H5*        A   6  -3.135   8.335  17.307
   57   2H5*    A   6          2H5*        A   6  -2.632   6.842  16.479
   58    H4*    A   6           H4*        A   6  -4.915   8.657  15.563
   59    H3*    A   6           H3*        A   6  -4.941   6.058  17.142
   60    H2*    A   6           H2*        A   6  -7.107   5.697  16.158
   61   2HO*    A   6          2HO*        A   6  -7.528   8.105  16.371
   62    H1*    A   6           H1*        A   6  -6.318   6.583  13.646
   63    H8     A   6           H8         A   6  -3.464   4.456  14.680
   64   1H6     A   6          1H6         A   6  -7.046  -0.426  13.211
   65   2H6     A   6          2H6         A   6  -5.403   0.030  13.650
   66    H2     A   6           H2         A   6  -9.626   3.117  13.400
   67   1H5*    G   7          1H5*        G   7  -8.765   6.804  17.906
   68   2H5*    G   7          2H5*        G   7  -9.120   6.454  19.609
   69    H4*    G   7           H4*        G   7 -10.345   4.944  18.096
   70    H3*    G   7           H3*        G   7  -8.199   3.616  19.769
   71    H2*    G   7           H2*        G   7  -9.005   1.510  18.871
   72   2HO*    G   7          2HO*        G   7 -11.275   2.449  18.844
   73    H1*    G   7           H1*        G   7  -9.056   2.362  16.298
   74    H8     G   7           H8         G   7  -6.084   4.167  17.777
   75    H1     G   7           H1         G   7  -5.006  -2.101  16.832
   76   1H2     G   7          2H2         G   7  -6.939  -3.145  16.470
   77   2H2     G   7          1H2         G   7  -8.449  -2.241  16.329
   78   1H5*    A   8          1H5*        A   8 -11.675   1.186  20.189
   79   2H5*    A   8          2H5*        A   8 -11.859   0.640  21.862
   80    H4*    A   8           H4*        A   8 -11.715  -1.213  20.165
   81    H3*    A   8           H3*        A   8  -9.641  -1.049  22.360
   82    H2*    A   8           H2*        A   8  -8.821  -3.186  21.564
   83   2HO*    A   8          2HO*        A   8 -11.153  -3.790  21.060
   84    H1*    A   8           H1*        A   8  -8.893  -2.505  18.915
   85    H8     A   8           H8         A   8  -7.725   0.692  20.477
   86   1H6     A   8          1H6         A   8  -2.075  -1.930  20.221
   87   2H6     A   8          2H6         A   8  -2.945  -0.408  20.359
   88    H2     A   8           H2         A   8  -5.090  -5.139  19.825
   89   1H5*    C   9          1H5*        C   9 -11.127  -5.066  22.598
   90   2H5*    C   9          2H5*        C   9 -11.402  -5.497  24.298
   91    H4*    C   9           H4*        C   9  -9.784  -7.036  23.215
   92    H3*    C   9           H3*        C   9  -8.645  -5.209  25.362
   93    H2*    C   9           H2*        C   9  -6.597  -6.397  25.163
   94   2HO*    C   9          2HO*        C   9  -6.462  -8.303  23.876
   95    H1*    C   9           H1*        C   9  -6.707  -6.550  22.382
   96   1H4     C   9          2H4         C   9  -2.805  -1.756  23.420
   97   2H4     C   9          1H4         C   9  -4.128  -0.606  23.623
   98    H5     C   9           H5         C   9  -6.488  -1.369  23.743
   99    H6     C   9           H6         C   9  -7.923  -3.297  23.562
  100    H3T    C   9           H3T        C   9  -9.013  -7.985  25.476
  101   1H5*    G  10          1H5*        G  10   6.926  -5.175  21.562
  102   2H5*    G  10          2H5*        G  10   7.026  -6.496  20.390
  103    H4*    G  10           H4*        G  10   6.011  -7.524  22.204
  104    H3*    G  10           H3*        G  10   3.746  -6.549  20.430
  105    H2*    G  10           H2*        G  10   2.238  -7.645  21.847
  106   2HO*    G  10          2HO*        G  10   3.832  -9.445  22.181
  107    H1*    G  10           H1*        G  10   3.376  -6.720  24.145
  108    H8     G  10           H8         G  10   3.999  -3.631  22.413
  109    H1     G  10           H1         G  10  -2.323  -4.525  23.193
  110   1H2     G  10          2H2         G  10  -2.739  -6.713  23.395
  111   2H2     G  10          1H2         G  10  -1.425  -7.884  23.525
  112    H5T    G  10           H5T        G  10   5.318  -5.674  19.269
  113   1H5*    U  11          1H5*        U  11   2.875 -10.407  19.776
  114   2H5*    U  11          2H5*        U  11   2.602 -10.712  18.052
  115    H4*    U  11           H4*        U  11   0.540 -10.972  19.358
  116    H3*    U  11           H3*        U  11   0.572  -8.584  17.497
  117    H2*    U  11           H2*        U  11  -1.749  -8.290  18.091
  118   2HO*    U  11          2HO*        U  11  -2.060 -10.678  18.166
  119    H1*    U  11           H1*        U  11  -1.384  -8.655  20.748
  120    H3     U  11           H3         U  11  -2.340  -4.254  19.904
  121    H5     U  11           H5         U  11   1.831  -4.575  19.484
  122    H6     U  11           H6         U  11   1.618  -6.977  19.664
  123   1H5*    C  12          1H5*        C  12  -3.084 -10.825  16.592
  124   2H5*    C  12          2H5*        C  12  -3.403 -10.719  14.853
  125    H4*    C  12           H4*        C  12  -5.250  -9.842  16.336
  126    H3*    C  12           H3*        C  12  -3.960  -7.983  14.325
  127    H2*    C  12           H2*        C  12  -5.621  -6.363  14.955
  128   2HO*    C  12          2HO*        C  12  -7.224  -8.214  15.167
  129    H1*    C  12           H1*        C  12  -5.495  -6.879  17.658
  130   1H4     C  12          2H4         C  12  -2.105  -1.688  16.907
  131   2H4     C  12          1H4         C  12  -0.594  -2.593  16.757
  132    H5     C  12           H5         C  12  -0.629  -5.084  16.476
  133    H6     C  12           H6         C  12  -2.072  -7.024  16.500
  134   1H5*    G  13          1H5*        G  13  -7.868  -6.838  13.617
  135   2H5*    G  13          2H5*        G  13  -8.103  -6.804  11.862
  136    H4*    G  13           H4*        G  13  -8.425  -4.579  12.798
  137    H3*    G  13           H3*        G  13  -5.928  -4.886  11.121
  138    H2*    G  13           H2*        G  13  -5.627  -2.524  11.301
  139   2HO*    G  13          2HO*        G  13  -7.896  -1.993  11.084
  140    H1*    G  13           H1*        G  13  -6.161  -2.420  13.997
  141    H8     G  13           H8         G  13  -4.319  -5.627  12.951
  142    H1     G  13           H1         G  13  -0.435  -0.588  13.806
  143   1H2     G  13          1H2         G  13  -1.621   1.226  14.252
  144   2H2     G  13          2H2         G  13  -3.365   1.218  14.273
  145   1H5*    A  14          1H5*        A  14  -7.686  -1.417   7.247
  146   2H5*    A  14          2H5*        A  14  -6.542  -0.958   8.533
  147    H4*    A  14           H4*        A  14  -9.499  -0.194   8.473
  148    H3*    A  14           H3*        A  14  -7.017   1.311   7.604
  149    H2*    A  14           H2*        A  14  -8.084   3.336   8.359
  150   2HO*    A  14          2HO*        A  14 -10.232   2.395   7.625
  151    H1*    A  14           H1*        A  14  -8.893   2.285  10.747
  152    H8     A  14           H8         A  14  -5.651   0.526  10.416
  153   1H6     A  14          1H6         A  14  -2.974   5.978  11.844
  154   2H6     A  14          2H6         A  14  -2.651   4.259  11.607
  155    H2     A  14           H2         A  14  -7.157   6.760  10.731
  156   1H5*    A  15          1H5*        A  15  -9.565   4.184   6.309
  157   2H5*    A  15          2H5*        A  15  -9.170   4.566   4.623
  158    H4*    A  15           H4*        A  15  -8.979   6.550   6.048
  159    H3*    A  15           H3*        A  15  -6.390   5.502   4.885
  160    H2*    A  15           H2*        A  15  -5.309   7.442   5.825
  161   2HO*    A  15          2HO*        A  15  -7.354   8.718   5.327
  162    H1*    A  15           H1*        A  15  -6.517   7.275   8.259
  163    H8     A  15           H8         A  15  -6.031   3.692   7.373
  164   1H6     A  15          1H6         A  15  -0.033   4.486   8.817
  165   2H6     A  15          2H6         A  15  -1.259   3.278   8.400
  166    H2     A  15           H2         A  15  -1.931   8.443   8.753
  167   1H5*    G  16          1H5*        G  16  -5.942   9.558   4.058
  168   2H5*    G  16          2H5*        G  16  -5.399   9.745   2.382
  169    H4*    G  16           H4*        G  16  -3.803  10.709   4.011
  170    H3*    G  16           H3*        G  16  -2.851   8.341   2.387
  171    H2*    G  16           H2*        G  16  -0.665   8.732   3.348
  172   2HO*    G  16          2HO*        G  16  -1.091  11.127   3.273
  173    H1*    G  16           H1*        G  16  -1.573   9.061   5.896
  174    H8     G  16           H8         G  16  -3.790   6.364   4.461
  175    H1     G  16           H1         G  16   2.112   4.288   5.959
  176   1H2     G  16          1H2         G  16   3.456   5.836   6.020
  177   2H2     G  16          2H2         G  16   3.138   7.498   5.861
  178   1H5*    C  17          1H5*        C  17   0.077  11.506   1.841
  179   2H5*    C  17          2H5*        C  17   0.659  11.506   0.167
  180    H4*    C  17           H4*        C  17   2.470  11.219   1.874
  181    H3*    C  17           H3*        C  17   2.007   8.956  -0.086
  182    H2*    C  17           H2*        C  17   4.034   7.977   0.823
  183   2HO*    C  17          2HO*        C  17   4.895  10.280   1.124
  184    H1*    C  17           H1*        C  17   3.353   8.464   3.429
  185   1H4     C  17          2H4         C  17   1.477   2.543   2.617
  186   2H4     C  17          1H4         C  17  -0.168   3.056   2.240
  187    H5     C  17           H5         C  17  -0.672   5.443   1.711
  188    H6     C  17           H6         C  17   0.251   7.675   1.719
  189   1H5*    C  18          1H5*        C  18   6.175   9.944  -0.151
  190   2H5*    C  18          2H5*        C  18   6.761  10.129  -1.805
  191    H4*    C  18           H4*        C  18   8.098   8.558  -0.335
  192    H3*    C  18           H3*        C  18   7.583   8.328  -3.064
  193    H2*    C  18           H2*        C  18   5.824   6.752  -2.816
  194   2HO*    C  18          2HO*        C  18   6.808   4.619  -3.144
  195    H1*    C  18           H1*        C  18   7.475   5.449  -0.621
  196   1H4     C  18          2H4         C  18   2.451   1.654  -0.318
  197   2H4     C  18          1H4         C  18   1.285   2.976  -0.375
  198    H5     C  18           H5         C  18   2.034   5.332  -0.739
  199    H6     C  18           H6         C  18   3.991   6.751  -0.950
  200    H3T    C  18           H3T        C  18   9.119   6.429  -2.688
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1   6.209  -8.725   1.070
    2   2H5*    G   1          2H5*        G   1   6.803  -8.533   2.728
    3    H4*    G   1           H4*        G   1   8.359  -7.442   1.266
    4    H3*    G   1           H3*        G   1   6.597  -5.423   2.686
    5    H2*    G   1           H2*        G   1   8.037  -3.731   1.791
    6   2HO*    G   1          2HO*        G   1   9.959  -5.171   2.034
    7    H1*    G   1           H1*        G   1   7.999  -4.767  -0.732
    8    H8     G   1           H8         G   1   4.548  -5.591   0.408
    9    H1     G   1           H1         G   1   5.316   0.714  -0.631
   10   1H2     G   1          2H2         G   1   7.504   1.190  -0.747
   11   2H2     G   1          1H2         G   1   8.717  -0.087  -0.640
   12    H5T    G   1           H5T        G   1   5.269  -6.945   3.078
   13   1H5*    G   2          1H5*        G   2  10.475  -4.173   3.712
   14   2H5*    G   2          2H5*        G   2  10.513  -3.666   5.409
   15    H4*    G   2           H4*        G   2  11.215  -1.881   3.820
   16    H3*    G   2           H3*        G   2   8.723  -1.382   5.462
   17    H2*    G   2           H2*        G   2   8.750   0.860   4.559
   18   2HO*    G   2          2HO*        G   2  11.184   0.836   4.620
   19    H1*    G   2           H1*        G   2   9.224   0.081   1.996
   20    H8     G   2           H8         G   2   6.863  -2.535   3.356
   21    H1     G   2           H1         G   2   4.057   3.165   2.329
   22   1H2     G   2          2H2         G   2   5.663   4.748   2.142
   23   2H2     G   2          1H2         G   2   7.367   4.288   2.108
   24   1H5*    C   3          1H5*        C   3  11.257   2.118   5.998
   25   2H5*    C   3          2H5*        C   3  11.187   2.631   7.691
   26    H4*    C   3           H4*        C   3  10.540   4.416   6.052
   27    H3*    C   3           H3*        C   3   8.455   3.501   8.054
   28    H2*    C   3           H2*        C   3   7.121   5.330   7.239
   29   2HO*    C   3          2HO*        C   3   9.170   6.647   6.997
   30    H1*    C   3           H1*        C   3   7.673   4.893   4.594
   31   1H4     C   3          2H4         C   3   2.061   2.035   5.536
   32   2H4     C   3          1H4         C   3   2.921   0.551   5.859
   33    H5     C   3           H5         C   3   5.317   0.395   6.187
   34    H6     C   3           H6         C   3   7.395   1.610   6.082
   35   1H5*    U   4          1H5*        U   4   7.955   7.545   8.524
   36   2H5*    U   4          2H5*        U   4   7.788   7.933  10.245
   37    H4*    U   4           H4*        U   4   5.746   8.487   8.951
   38    H3*    U   4           H3*        U   4   5.462   6.271  10.995
   39    H2*    U   4           H2*        U   4   3.095   6.325  10.511
   40   2HO*    U   4          2HO*        U   4   3.175   8.719  10.230
   41    H1*    U   4           H1*        U   4   3.417   6.445   7.801
   42    H3     U   4           H3         U   4   1.758   2.303   8.890
   43    H5     U   4           H5         U   4   5.912   1.964   9.380
   44    H6     U   4           H6         U   4   6.113   4.342   9.041
   45   1H5*    A   5          1H5*        A   5   2.239   9.154  11.713
   46   2H5*    A   5          2H5*        A   5   1.934   9.253  13.454
   47    H4*    A   5           H4*        A   5  -0.074   8.554  12.132
   48    H3*    A   5           H3*        A   5   1.062   6.565  14.110
   49    H2*    A   5           H2*        A   5  -0.915   5.241  13.687
   50   2HO*    A   5          2HO*        A   5  -2.360   7.100  13.537
   51    H1*    A   5           H1*        A   5  -0.794   5.581  10.949
   52    H8     A   5           H8         A   5   2.707   5.204  12.510
   53   1H6     A   5          1H6         A   5   1.657  -0.921  12.177
   54   2H6     A   5          2H6         A   5   2.897   0.294  12.482
   55    H2     A   5           H2         A   5  -2.053   1.124  11.032
   56   1H5*    A   6          1H5*        A   6  -2.696   6.820  17.845
   57   2H5*    A   6          2H5*        A   6  -3.281   5.481  16.862
   58    H4*    A   6           H4*        A   6  -3.554   8.461  16.276
   59    H3*    A   6           H3*        A   6  -5.368   6.212  17.074
   60    H2*    A   6           H2*        A   6  -7.059   6.695  15.541
   61   2HO*    A   6          2HO*        A   6  -6.504   9.099  15.881
   62    H1*    A   6           H1*        A   6  -5.487   6.984  13.377
   63    H8     A   6           H8         A   6  -3.083   4.706  14.667
   64   1H6     A   6          1H6         A   6  -6.972   0.044  13.485
   65   2H6     A   6          2H6         A   6  -5.310   0.459  13.886
   66    H2     A   6           H2         A   6  -9.347   3.772  13.532
   67   1H5*    G   7          1H5*        G   7  -8.198   7.390  17.982
   68   2H5*    G   7          2H5*        G   7  -8.705   7.034  19.645
   69    H4*    G   7           H4*        G   7  -9.652   5.465  17.951
   70    H3*    G   7           H3*        G   7  -7.714   4.219  19.926
   71    H2*    G   7           H2*        G   7  -8.431   2.099  18.975
   72   2HO*    G   7          2HO*        G   7 -10.677   3.010  18.688
   73    H1*    G   7           H1*        G   7  -8.227   2.975  16.394
   74    H8     G   7           H8         G   7  -5.322   4.541  18.270
   75    H1     G   7           H1         G   7  -4.540  -1.741  17.128
   76   1H2     G   7          2H2         G   7  -6.509  -2.654  16.623
   77   2H2     G   7          1H2         G   7  -7.945  -1.650  16.406
   78   1H5*    A   8          1H5*        A   8 -11.308   1.865  19.992
   79   2H5*    A   8          2H5*        A   8 -11.662   1.313  21.635
   80    H4*    A   8           H4*        A   8 -11.430  -0.529  19.935
   81    H3*    A   8           H3*        A   8  -9.545  -0.469  22.301
   82    H2*    A   8           H2*        A   8  -8.767  -2.639  21.549
   83   2HO*    A   8          2HO*        A   8 -11.069  -3.135  20.851
   84    H1*    A   8           H1*        A   8  -8.593  -1.925  18.912
   85    H8     A   8           H8         A   8  -7.396   1.164  20.690
   86   1H6     A   8          1H6         A   8  -1.876  -1.741  20.724
   87   2H6     A   8          2H6         A   8  -2.673  -0.180  20.875
   88    H2     A   8           H2         A   8  -5.003  -4.759  19.940
   89   1H5*    C   9          1H5*        C   9 -11.274  -4.418  22.340
   90   2H5*    C   9          2H5*        C   9 -11.683  -4.868  24.008
   91    H4*    C   9           H4*        C   9 -10.090  -6.476  22.985
   92    H3*    C   9           H3*        C   9  -8.994  -4.777  25.256
   93    H2*    C   9           H2*        C   9  -7.012  -6.087  25.159
   94   2HO*    C   9          2HO*        C   9  -6.907  -7.964  23.826
   95    H1*    C   9           H1*        C   9  -6.943  -6.161  22.373
   96   1H4     C   9          2H4         C   9  -2.840  -1.647  23.838
   97   2H4     C   9          1H4         C   9  -4.104  -0.428  24.013
   98    H5     C   9           H5         C   9  -6.506  -1.049  23.951
   99    H6     C   9           H6         C   9  -8.038  -2.877  23.598
  100    H3T    C   9           H3T        C   9  -9.537  -7.527  25.265
  101   1H5*    G  10          1H5*        G  10   6.796  -5.568  22.594
  102   2H5*    G  10          2H5*        G  10   6.916  -6.865  21.397
  103    H4*    G  10           H4*        G  10   5.701  -7.874  23.095
  104    H3*    G  10           H3*        G  10   3.646  -6.724  21.177
  105    H2*    G  10           H2*        G  10   1.968  -7.765  22.436
  106   2HO*    G  10          2HO*        G  10   3.426  -9.665  22.842
  107    H1*    G  10           H1*        G  10   2.969  -6.968  24.845
  108    H8     G  10           H8         G  10   3.902  -3.876  23.272
  109    H1     G  10           H1         G  10  -2.503  -4.419  23.513
  110   1H2     G  10          2H2         G  10  -3.058  -6.583  23.609
  111   2H2     G  10          1H2         G  10  -1.827  -7.833  23.801
  112    H5T    G  10           H5T        G  10   5.350  -5.919  20.169
  113   1H5*    U  11          1H5*        U  11   2.605 -10.500  20.369
  114   2H5*    U  11          2H5*        U  11   2.453 -10.761  18.623
  115    H4*    U  11           H4*        U  11   0.284 -10.922  19.760
  116    H3*    U  11           H3*        U  11   0.597  -8.515  17.951
  117    H2*    U  11           H2*        U  11  -1.740  -8.092  18.369
  118   2HO*    U  11          2HO*        U  11  -2.206 -10.450  18.370
  119    H1*    U  11           H1*        U  11  -1.613  -8.518  21.037
  120    H3     U  11           H3         U  11  -2.243  -4.053  20.237
  121    H5     U  11           H5         U  11   1.923  -4.613  20.149
  122    H6     U  11           H6         U  11   1.557  -7.002  20.235
  123   1H5*    C  12          1H5*        C  12  -3.096 -10.564  16.728
  124   2H5*    C  12          2H5*        C  12  -3.280 -10.408  14.973
  125    H4*    C  12           H4*        C  12  -5.188  -9.471  16.338
  126    H3*    C  12           H3*        C  12  -3.666  -7.640  14.469
  127    H2*    C  12           H2*        C  12  -5.287  -5.948  15.013
  128   2HO*    C  12          2HO*        C  12  -6.989  -7.720  15.069
  129    H1*    C  12           H1*        C  12  -5.383  -6.522  17.707
  130   1H4     C  12          2H4         C  12  -1.663  -1.518  17.377
  131   2H4     C  12          1H4         C  12  -0.200  -2.502  17.264
  132    H5     C  12           H5         C  12  -0.355  -4.974  16.897
  133    H6     C  12           H6         C  12  -1.900  -6.827  16.761
  134   1H5*    G  13          1H5*        G  13  -7.543  -6.410  13.498
  135   2H5*    G  13          2H5*        G  13  -7.641  -6.312  11.734
  136    H4*    G  13           H4*        G  13  -8.042  -4.127  12.735
  137    H3*    G  13           H3*        G  13  -5.425  -4.347  11.230
  138    H2*    G  13           H2*        G  13  -5.209  -1.968  11.515
  139   2HO*    G  13          2HO*        G  13  -7.509  -1.536  11.207
  140    H1*    G  13           H1*        G  13  -5.866  -2.008  14.170
  141    H8     G  13           H8         G  13  -3.955  -5.171  13.105
  142    H1     G  13           H1         G  13  -0.140  -0.200  14.486
  143   1H2     G  13          1H2         G  13  -1.350   1.625  14.843
  144   2H2     G  13          2H2         G  13  -3.087   1.629  14.654
  145   1H5*    A  14          1H5*        A  14  -9.369  -2.161   9.829
  146   2H5*    A  14          2H5*        A  14  -9.269  -1.931   8.073
  147    H4*    A  14           H4*        A  14 -10.454  -0.085   9.253
  148    H3*    A  14           H3*        A  14  -7.910   0.583   7.766
  149    H2*    A  14           H2*        A  14  -8.308   2.876   8.298
  150   2HO*    A  14          2HO*        A  14 -10.594   2.745   7.829
  151    H1*    A  14           H1*        A  14  -9.203   2.434  10.878
  152    H8     A  14           H8         A  14  -6.191   0.229  10.373
  153   1H6     A  14          1H6         A  14  -2.953   5.456  11.553
  154   2H6     A  14          2H6         A  14  -2.761   3.715  11.360
  155    H2     A  14           H2         A  14  -7.083   6.570  10.693
  156   1H5*    A  15          1H5*        A  15  -8.234   3.645   4.192
  157   2H5*    A  15          2H5*        A  15  -7.235   3.156   5.568
  158    H4*    A  15           H4*        A  15  -9.114   5.562   5.606
  159    H3*    A  15           H3*        A  15  -6.237   5.233   4.771
  160    H2*    A  15           H2*        A  15  -5.611   7.261   5.865
  161   2HO*    A  15          2HO*        A  15  -7.840   8.153   5.236
  162    H1*    A  15           H1*        A  15  -6.898   6.748   8.194
  163    H8     A  15           H8         A  15  -6.130   3.276   7.481
  164   1H6     A  15          1H6         A  15  -0.121   4.454   8.527
  165   2H6     A  15          2H6         A  15  -1.309   3.172   8.255
  166    H2     A  15           H2         A  15  -2.243   8.304   8.415
  167   1H5*    G  16          1H5*        G  16  -6.074   9.043   4.026
  168   2H5*    G  16          2H5*        G  16  -5.619   9.332   2.336
  169    H4*    G  16           H4*        G  16  -3.986  10.324   3.878
  170    H3*    G  16           H3*        G  16  -3.014   7.982   2.227
  171    H2*    G  16           H2*        G  16  -0.811   8.411   3.114
  172   2HO*    G  16          2HO*        G  16  -1.317  10.804   3.061
  173    H1*    G  16           H1*        G  16  -1.638   8.722   5.695
  174    H8     G  16           H8         G  16  -3.913   6.012   4.481
  175    H1     G  16           H1         G  16   2.111   3.982   5.477
  176   1H2     G  16          1H2         G  16   3.447   5.537   5.413
  177   2H2     G  16          2H2         G  16   3.109   7.198   5.273
  178   1H5*    C  17          1H5*        C  17  -0.096  11.118   1.613
  179   2H5*    C  17          2H5*        C  17   0.310  11.185  -0.111
  180    H4*    C  17           H4*        C  17   2.304  10.860   1.341
  181    H3*    C  17           H3*        C  17   1.584   8.613  -0.560
  182    H2*    C  17           H2*        C  17   3.686   7.604   0.067
  183   2HO*    C  17          2HO*        C  17   4.650   9.855   0.189
  184    H1*    C  17           H1*        C  17   3.397   8.150   2.751
  185   1H4     C  17          2H4         C  17   1.517   2.176   2.291
  186   2H4     C  17          1H4         C  17  -0.159   2.659   2.042
  187    H5     C  17           H5         C  17  -0.761   5.028   1.563
  188    H6     C  17           H6         C  17   0.109   7.282   1.465
  189   1H5*    C  18          1H5*        C  18   5.836   9.583  -1.305
  190   2H5*    C  18          2H5*        C  18   6.029   9.644  -3.065
  191    H4*    C  18           H4*        C  18   7.652   8.088  -2.092
  192    H3*    C  18           H3*        C  18   5.418   6.717  -3.648
  193    H2*    C  18           H2*        C  18   6.696   4.717  -3.434
  194   2HO*    C  18          2HO*        C  18   8.734   6.021  -3.744
  195    H1*    C  18           H1*        C  18   7.391   5.220  -0.783
  196   1H4     C  18          2H4         C  18   2.558   1.172  -0.513
  197   2H4     C  18          1H4         C  18   1.359   2.446  -0.728
  198    H5     C  18           H5         C  18   2.040   4.772  -1.302
  199    H6     C  18           H6         C  18   3.945   6.229  -1.614
  200    H3T    C  18           H3T        C  18   6.685   8.132  -4.887
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1   3.805  -8.129   1.472
    2   2H5*    G   1          2H5*        G   1   5.079  -8.264   2.693
    3    H4*    G   1           H4*        G   1   6.243  -7.592   0.792
    4    H3*    G   1           H3*        G   1   5.587  -5.055   2.332
    5    H2*    G   1           H2*        G   1   6.964  -3.886   0.822
    6   2HO*    G   1          2HO*        G   1   8.473  -5.769   0.662
    7    H1*    G   1           H1*        G   1   5.825  -5.022  -1.376
    8    H8     G   1           H8         G   1   2.721  -5.074   0.452
    9    H1     G   1           H1         G   1   4.488   0.999  -0.706
   10   1H2     G   1          2H2         G   1   6.701   1.083  -1.023
   11   2H2     G   1          1H2         G   1   7.665  -0.392  -1.117
   12    H5T    G   1           H5T        G   1   4.455  -6.341   3.591
   13   1H5*    G   2          1H5*        G   2   9.517  -4.756   2.949
   14   2H5*    G   2          2H5*        G   2   9.876  -4.326   4.629
   15    H4*    G   2           H4*        G   2  10.482  -2.554   2.998
   16    H3*    G   2           H3*        G   2   8.312  -1.890   4.997
   17    H2*    G   2           H2*        G   2   8.357   0.345   4.114
   18   2HO*    G   2          2HO*        G   2  10.789   0.119   3.838
   19    H1*    G   2           H1*        G   2   8.481  -0.385   1.493
   20    H8     G   2           H8         G   2   6.045  -2.823   2.916
   21    H1     G   2           H1         G   2   3.726   3.175   2.587
   22   1H2     G   2          2H2         G   2   5.471   4.617   2.382
   23   2H2     G   2          1H2         G   2   7.109   3.991   2.187
   24   1H5*    C   3          1H5*        C   3  11.087   1.438   5.123
   25   2H5*    C   3          2H5*        C   3  11.407   1.855   6.813
   26    H4*    C   3           H4*        C   3  10.538   3.775   5.428
   27    H3*    C   3           H3*        C   3   9.025   2.809   7.857
   28    H2*    C   3           H2*        C   3   7.417   4.455   7.493
   29   2HO*    C   3          2HO*        C   3   8.933   6.172   7.212
   30    H1*    C   3           H1*        C   3   7.566   4.534   4.695
   31   1H4     C   3          2H4         C   3   1.933   1.998   5.876
   32   2H4     C   3          1H4         C   3   2.628   0.386   5.989
   33    H5     C   3           H5         C   3   5.072   0.019   6.046
   34    H6     C   3           H6         C   3   7.218   1.109   5.825
   35   1H5*    U   4          1H5*        U   4   8.186   6.041  11.183
   36   2H5*    U   4          2H5*        U   4   7.621   4.687  10.201
   37    H4*    U   4           H4*        U   4   6.991   7.585   9.503
   38    H3*    U   4           H3*        U   4   5.608   5.664  11.374
   39    H2*    U   4           H2*        U   4   3.470   6.409  10.577
   40   2HO*    U   4          2HO*        U   4   4.436   8.660  10.307
   41    H1*    U   4           H1*        U   4   4.112   6.285   7.944
   42    H3     U   4           H3         U   4   1.431   2.686   9.083
   43    H5     U   4           H5         U   4   5.389   1.343   9.397
   44    H6     U   4           H6         U   4   6.151   3.610   9.127
   45   1H5*    A   5          1H5*        A   5   3.124   8.926  11.851
   46   2H5*    A   5          2H5*        A   5   2.868   9.233  13.578
   47    H4*    A   5           H4*        A   5   0.739   8.781  12.448
   48    H3*    A   5           H3*        A   5   1.644   6.604  14.356
   49    H2*    A   5           H2*        A   5  -0.522   5.619  14.042
   50   2HO*    A   5          2HO*        A   5  -1.690   7.649  13.986
   51    H1*    A   5           H1*        A   5  -0.485   5.908  11.316
   52    H8     A   5           H8         A   5   3.043   5.161  12.663
   53   1H6     A   5          1H6         A   5   1.344  -0.813  12.512
   54   2H6     A   5          2H6         A   5   2.710   0.277  12.736
   55    H2     A   5           H2         A   5  -2.186   1.593  11.498
   56   1H5*    A   6          1H5*        A   6  -2.732   7.853  17.664
   57   2H5*    A   6          2H5*        A   6  -2.694   6.389  16.653
   58    H4*    A   6           H4*        A   6  -4.180   8.977  15.988
   59    H3*    A   6           H3*        A   6  -5.070   6.320  17.127
   60    H2*    A   6           H2*        A   6  -7.132   6.520  15.918
   61   2HO*    A   6          2HO*        A   6  -7.025   8.951  16.247
   62    H1*    A   6           H1*        A   6  -5.944   7.111  13.559
   63    H8     A   6           H8         A   6  -3.213   5.000  14.756
   64   1H6     A   6          1H6         A   6  -6.824   0.095  13.522
   65   2H6     A   6          2H6         A   6  -5.186   0.567  13.963
   66    H2     A   6           H2         A   6  -9.390   3.661  13.543
   67   1H5*    G   7          1H5*        G   7  -8.288   7.217  18.042
   68   2H5*    G   7          2H5*        G   7  -8.735   6.839  19.717
   69    H4*    G   7           H4*        G   7  -9.805   5.332  18.047
   70    H3*    G   7           H3*        G   7  -7.825   4.018  19.929
   71    H2*    G   7           H2*        G   7  -8.590   1.919  18.975
   72   2HO*    G   7          2HO*        G   7 -10.834   2.854  18.769
   73    H1*    G   7           H1*        G   7  -8.441   2.796  16.398
   74    H8     G   7           H8         G   7  -5.506   4.430  18.127
   75    H1     G   7           H1         G   7  -4.687  -1.886  17.199
   76   1H2     G   7          2H2         G   7  -6.623  -2.813  16.615
   77   2H2     G   7          1H2         G   7  -8.066  -1.826  16.364
   78   1H5*    A   8          1H5*        A   8 -11.465   1.733  20.099
   79   2H5*    A   8          2H5*        A   8 -11.771   1.159  21.744
   80    H4*    A   8           H4*        A   8 -11.615  -0.657  20.006
   81    H3*    A   8           H3*        A   8  -9.649  -0.666  22.306
   82    H2*    A   8           H2*        A   8  -8.935  -2.841  21.483
   83   2HO*    A   8          2HO*        A   8 -11.265  -3.269  20.816
   84    H1*    A   8           H1*        A   8  -8.786  -2.045  18.874
   85    H8     A   8           H8         A   8  -7.569   1.003  20.711
   86   1H6     A   8          1H6         A   8  -2.079  -1.955  20.775
   87   2H6     A   8          2H6         A   8  -2.866  -0.391  20.960
   88    H2     A   8           H2         A   8  -5.215  -4.922  19.857
   89   1H5*    C   9          1H5*        C   9 -11.366  -4.598  22.235
   90   2H5*    C   9          2H5*        C   9 -11.792  -5.089  23.884
   91    H4*    C   9           H4*        C   9 -10.258  -6.723  22.853
   92    H3*    C   9           H3*        C   9  -8.978  -5.062  25.058
   93    H2*    C   9           H2*        C   9  -7.144  -6.585  24.927
   94   2HO*    C   9          2HO*        C   9  -7.200  -8.408  23.567
   95    H1*    C   9           H1*        C   9  -7.122  -6.531  22.147
   96   1H4     C   9          2H4         C   9  -2.797  -2.315  23.960
   97   2H4     C   9          1H4         C   9  -4.001  -1.037  24.138
   98    H5     C   9           H5         C   9  -6.425  -1.512  23.926
   99    H6     C   9           H6         C   9  -8.044  -3.234  23.448
  100    H3T    C   9           H3T        C   9 -10.772  -6.287  25.718
  101   1H5*    G  10          1H5*        G  10   6.922  -6.879  23.749
  102   2H5*    G  10          2H5*        G  10   6.913  -7.322  22.032
  103    H4*    G  10           H4*        G  10   5.521  -8.862  23.310
  104    H3*    G  10           H3*        G  10   4.049  -7.020  21.418
  105    H2*    G  10           H2*        G  10   2.028  -8.189  21.970
  106   2HO*    G  10          2HO*        G  10   3.331 -10.259  22.095
  107    H1*    G  10           H1*        G  10   2.461  -8.246  24.653
  108    H8     G  10           H8         G  10   3.842  -4.888  23.852
  109    H1     G  10           H1         G  10  -2.582  -5.067  23.510
  110   1H2     G  10          2H2         G  10  -3.255  -7.195  23.327
  111   2H2     G  10          1H2         G  10  -2.100  -8.526  23.436
  112    H5T    G  10           H5T        G  10   6.637  -5.118  22.175
  113   1H5*    U  11          1H5*        U  11   2.421 -10.764  20.351
  114   2H5*    U  11          2H5*        U  11   2.357 -10.878  18.584
  115    H4*    U  11           H4*        U  11   0.125 -11.105  19.628
  116    H3*    U  11           H3*        U  11   0.554  -8.648  17.909
  117    H2*    U  11           H2*        U  11  -1.820  -8.253  18.176
  118   2HO*    U  11          2HO*        U  11  -2.268 -10.607  18.095
  119    H1*    U  11           H1*        U  11  -1.840  -8.747  20.840
  120    H3     U  11           H3         U  11  -2.487  -4.275  20.337
  121    H5     U  11           H5         U  11   1.685  -4.768  20.253
  122    H6     U  11           H6         U  11   1.359  -7.156  20.128
  123   1H5*    C  12          1H5*        C  12  -3.068 -10.655  16.384
  124   2H5*    C  12          2H5*        C  12  -3.140 -10.416  14.631
  125    H4*    C  12           H4*        C  12  -5.137  -9.549  15.900
  126    H3*    C  12           H3*        C  12  -3.499  -7.599  14.263
  127    H2*    C  12           H2*        C  12  -5.191  -5.964  14.779
  128   2HO*    C  12          2HO*        C  12  -6.871  -7.733  14.597
  129    H1*    C  12           H1*        C  12  -5.465  -6.702  17.420
  130   1H4     C  12          2H4         C  12  -1.807  -1.628  17.578
  131   2H4     C  12          1H4         C  12  -0.323  -2.580  17.465
  132    H5     C  12           H5         C  12  -0.419  -5.029  16.956
  133    H6     C  12           H6         C  12  -1.922  -6.894  16.633
  134   1H5*    G  13          1H5*        G  13  -7.349  -6.398  13.078
  135   2H5*    G  13          2H5*        G  13  -7.325  -6.189  11.321
  136    H4*    G  13           H4*        G  13  -7.868  -4.079  12.468
  137    H3*    G  13           H3*        G  13  -5.105  -4.091  11.236
  138    H2*    G  13           H2*        G  13  -5.090  -1.727  11.523
  139   2HO*    G  13          2HO*        G  13  -7.530  -1.526  11.210
  140    H1*    G  13           H1*        G  13  -5.873  -1.996  14.134
  141    H8     G  13           H8         G  13  -3.783  -5.019  13.049
  142    H1     G  13           H1         G  13  -0.233  -0.010  14.909
  143   1H2     G  13          1H2         G  13  -1.510   1.764  15.240
  144   2H2     G  13          2H2         G  13  -3.221   1.753  14.902
  145   1H5*    A  14          1H5*        A  14  -8.033  -1.262   7.733
  146   2H5*    A  14          2H5*        A  14  -6.773  -0.853   8.923
  147    H4*    A  14           H4*        A  14  -9.615   0.269   8.886
  148    H3*    A  14           H3*        A  14  -6.992   1.435   7.902
  149    H2*    A  14           H2*        A  14  -7.897   3.603   8.474
  150   2HO*    A  14          2HO*        A  14 -10.112   2.794   7.799
  151    H1*    A  14           H1*        A  14  -8.797   2.797  10.929
  152    H8     A  14           H8         A  14  -5.654   0.829  10.668
  153   1H6     A  14          1H6         A  14  -2.680   6.184  11.860
  154   2H6     A  14          2H6         A  14  -2.458   4.440  11.712
  155    H2     A  14           H2         A  14  -6.825   7.138  10.731
  156   1H5*    A  15          1H5*        A  15  -9.433   4.370   6.346
  157   2H5*    A  15          2H5*        A  15  -8.960   4.649   4.660
  158    H4*    A  15           H4*        A  15  -8.780   6.696   6.009
  159    H3*    A  15           H3*        A  15  -6.173   5.560   4.974
  160    H2*    A  15           H2*        A  15  -5.116   7.561   5.836
  161   2HO*    A  15          2HO*        A  15  -7.151   8.808   5.243
  162    H1*    A  15           H1*        A  15  -6.361   7.478   8.249
  163    H8     A  15           H8         A  15  -5.888   3.863   7.505
  164   1H6     A  15          1H6         A  15   0.135   4.693   8.815
  165   2H6     A  15          2H6         A  15  -1.104   3.464   8.490
  166    H2     A  15           H2         A  15  -1.758   8.636   8.702
  167   1H5*    G  16          1H5*        G  16  -5.730   9.588   4.011
  168   2H5*    G  16          2H5*        G  16  -5.137   9.739   2.351
  169    H4*    G  16           H4*        G  16  -3.641  10.795   4.043
  170    H3*    G  16           H3*        G  16  -2.568   8.497   2.397
  171    H2*    G  16           H2*        G  16  -0.414   8.930   3.404
  172   2HO*    G  16          2HO*        G  16  -0.977  11.325   3.358
  173    H1*    G  16           H1*        G  16  -1.370   9.226   5.947
  174    H8     G  16           H8         G  16  -3.502   6.436   4.668
  175    H1     G  16           H1         G  16   2.567   4.589   5.745
  176   1H2     G  16          2H2         G  16   3.908   6.388   5.688
  177   2H2     G  16          1H2         G  16   3.223   8.013   5.673
  178   1H5*    C  17          1H5*        C  17   0.390  11.546   1.965
  179   2H5*    C  17          2H5*        C  17   0.874  11.656   0.263
  180    H4*    C  17           H4*        C  17   2.789  11.171   1.774
  181    H3*    C  17           H3*        C  17   2.018   9.041  -0.236
  182    H2*    C  17           H2*        C  17   4.002   7.854   0.446
  183   2HO*    C  17          2HO*        C  17   5.111  10.036   0.689
  184    H1*    C  17           H1*        C  17   3.646   8.324   3.131
  185   1H4     C  17          2H4         C  17   1.253   2.550   2.525
  186   2H4     C  17          1H4         C  17  -0.352   3.201   2.216
  187    H5     C  17           H5         C  17  -0.715   5.604   1.734
  188    H6     C  17           H6         C  17   0.350   7.770   1.693
  189   1H5*    C  18          1H5*        C  18   6.323   9.686  -0.847
  190   2H5*    C  18          2H5*        C  18   6.581   9.766  -2.600
  191    H4*    C  18           H4*        C  18   7.988   8.031  -1.581
  192    H3*    C  18           H3*        C  18   5.749   7.010  -3.367
  193    H2*    C  18           H2*        C  18   6.699   4.830  -3.136
  194   2HO*    C  18          2HO*        C  18   8.890   5.938  -1.689
  195    H1*    C  18           H1*        C  18   7.222   5.093  -0.420
  196   1H4     C  18          2H4         C  18   1.828   1.893  -0.555
  197   2H4     C  18          1H4         C  18   0.857   3.350  -0.766
  198    H5     C  18           H5         C  18   1.928   5.557  -1.191
  199    H6     C  18           H6         C  18   4.050   6.692  -1.379
  200    H3T    C  18           H3T        C  18   8.447   6.850  -3.983
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1   7.681  -8.123   1.856
    2   2H5*    G   1          2H5*        G   1   8.182  -7.774   3.518
    3    H4*    G   1           H4*        G   1   9.639  -6.561   2.051
    4    H3*    G   1           H3*        G   1   7.578  -4.723   3.302
    5    H2*    G   1           H2*        G   1   8.818  -2.904   2.362
    6   2HO*    G   1          2HO*        G   1  10.901  -4.060   2.747
    7    H1*    G   1           H1*        G   1   9.017  -4.059  -0.100
    8    H8     G   1           H8         G   1   5.659  -5.269   0.977
    9    H1     G   1           H1         G   1   5.644   1.018  -0.401
   10   1H2     G   1          2H2         G   1   7.754   1.772  -0.475
   11   2H2     G   1          1H2         G   1   9.117   0.672  -0.260
   12    H5T    G   1           H5T        G   1   6.443  -6.385   3.735
   13   1H5*    G   2          1H5*        G   2  11.224  -2.935   4.395
   14   2H5*    G   2          2H5*        G   2  11.124  -2.330   6.057
   15    H4*    G   2           H4*        G   2  11.654  -0.565   4.375
   16    H3*    G   2           H3*        G   2   9.062  -0.298   5.912
   17    H2*    G   2           H2*        G   2   8.827   1.866   4.863
   18   2HO*    G   2          2HO*        G   2  11.240   2.169   4.990
   19    H1*    G   2           H1*        G   2   9.486   1.002   2.371
   20    H8     G   2           H8         G   2   7.443  -1.818   3.836
   21    H1     G   2           H1         G   2   3.956   3.386   2.361
   22   1H2     G   2          2H2         G   2   5.349   5.153   2.120
   23   2H2     G   2          1H2         G   2   7.099   4.919   2.165
   24   1H5*    C   3          1H5*        C   3  11.119   3.531   6.274
   25   2H5*    C   3          2H5*        C   3  10.919   4.146   7.922
   26    H4*    C   3           H4*        C   3  10.117   5.714   6.132
   27    H3*    C   3           H3*        C   3   8.099   4.694   8.150
   28    H2*    C   3           H2*        C   3   6.571   6.272   7.165
   29   2HO*    C   3          2HO*        C   3   8.449   7.816   6.867
   30    H1*    C   3           H1*        C   3   7.260   5.716   4.576
   31   1H4     C   3          2H4         C   3   2.028   2.233   5.583
   32   2H4     C   3          1H4         C   3   3.057   0.900   6.045
   33    H5     C   3           H5         C   3   5.440   1.078   6.442
   34    H6     C   3           H6         C   3   7.349   2.540   6.301
   35   1H5*    U   4          1H5*        U   4   7.061   8.649   8.294
   36   2H5*    U   4          2H5*        U   4   6.801   9.140   9.977
   37    H4*    U   4           H4*        U   4   4.736   9.317   8.623
   38    H3*    U   4           H3*        U   4   4.702   7.225  10.812
   39    H2*    U   4           H2*        U   4   2.353   6.934  10.295
   40   2HO*    U   4          2HO*        U   4   2.123   9.289   9.842
   41    H1*    U   4           H1*        U   4   2.727   6.903   7.590
   42    H3     U   4           H3         U   4   1.628   2.653   8.927
   43    H5     U   4           H5         U   4   5.775   2.927   9.511
   44    H6     U   4           H6         U   4   5.655   5.284   9.019
   45   1H5*    A   5          1H5*        A   5   1.131   9.747  11.244
   46   2H5*    A   5          2H5*        A   5   0.807   9.981  12.967
   47    H4*    A   5           H4*        A   5  -1.124   8.991  11.761
   48    H3*    A   5           H3*        A   5   0.203   7.235  13.845
   49    H2*    A   5           H2*        A   5  -1.658   5.743  13.560
   50   2HO*    A   5          2HO*        A   5  -3.274   7.424  13.330
   51    H1*    A   5           H1*        A   5  -1.604   5.874  10.819
   52    H8     A   5           H8         A   5   1.928   5.984  12.380
   53   1H6     A   5          1H6         A   5   1.641  -0.228  12.115
   54   2H6     A   5          2H6         A   5   2.716   1.134  12.415
   55    H2     A   5           H2         A   5  -2.300   1.331  10.990
   56   1H5*    A   6          1H5*        A   6  -4.520   7.701  16.906
   57   2H5*    A   6          2H5*        A   6  -4.088   6.203  16.047
   58    H4*    A   6           H4*        A   6  -6.074   8.305  15.051
   59    H3*    A   6           H3*        A   6  -6.410   5.648  16.450
   60    H2*    A   6           H2*        A   6  -8.401   5.259  15.172
   61   2HO*    A   6          2HO*        A   6  -8.853   7.669  15.258
   62    H1*    A   6           H1*        A   6  -7.264   5.925  12.794
   63    H8     A   6           H8         A   6  -4.222   4.477  14.182
   64   1H6     A   6          1H6         A   6  -6.808  -1.123  13.320
   65   2H6     A   6          2H6         A   6  -5.291  -0.322  13.711
   66    H2     A   6           H2         A   6  -9.994   1.878  13.018
   67   1H5*    G   7          1H5*        G   7  -9.882   5.927  17.153
   68   2H5*    G   7          2H5*        G   7 -10.303   5.639  18.854
   69    H4*    G   7           H4*        G   7 -11.034   3.793  17.374
   70    H3*    G   7           H3*        G   7  -8.835   3.077  19.334
   71    H2*    G   7           H2*        G   7  -9.148   0.787  18.585
   72   2HO*    G   7          2HO*        G   7 -11.542   1.255  18.311
   73    H1*    G   7           H1*        G   7  -9.153   1.429  15.940
   74    H8     G   7           H8         G   7  -6.668   3.830  17.442
   75    H1     G   7           H1         G   7  -4.454  -2.198  17.146
   76   1H2     G   7          2H2         G   7  -6.156  -3.599  16.838
   77   2H2     G   7          1H2         G   7  -7.792  -2.997  16.550
   78   1H5*    A   8          1H5*        A   8 -11.790   0.046  19.742
   79   2H5*    A   8          2H5*        A   8 -12.036  -0.357  21.447
   80    H4*    A   8           H4*        A   8 -11.391  -2.310  20.010
   81    H3*    A   8           H3*        A   8  -9.578  -1.510  22.296
   82    H2*    A   8           H2*        A   8  -8.317  -3.528  21.823
   83   2HO*    A   8          2HO*        A   8 -10.464  -4.605  21.249
   84    H1*    A   8           H1*        A   8  -8.306  -3.173  19.108
   85    H8     A   8           H8         A   8  -7.847   0.335  20.346
   86   1H6     A   8          1H6         A   8  -1.806  -1.199  20.561
   87   2H6     A   8          2H6         A   8  -2.944   0.141  20.497
   88    H2     A   8           H2         A   8  -4.163  -4.937  20.439
   89   1H5*    C   9          1H5*        C   9 -10.275  -5.675  22.929
   90   2H5*    C   9          2H5*        C   9 -10.669  -5.948  24.637
   91    H4*    C   9           H4*        C   9  -8.702  -7.274  24.009
   92    H3*    C   9           H3*        C   9  -8.044  -4.896  25.799
   93    H2*    C   9           H2*        C   9  -5.843  -5.793  25.961
   94   2HO*    C   9          2HO*        C   9  -6.797  -8.040  25.994
   95    H1*    C   9           H1*        C   9  -5.697  -6.430  23.264
   96   1H4     C   9          2H4         C   9  -2.775  -0.868  23.668
   97   2H4     C   9          1H4         C   9  -4.288   0.040  23.693
   98    H5     C   9           H5         C   9  -6.479  -1.123  23.835
   99    H6     C   9           H6         C   9  -7.536  -3.290  23.864
  100    H3T    C   9           H3T        C   9  -9.412  -6.442  26.742
  101   1H5*    G  10          1H5*        G  10   7.503  -2.587  22.553
  102   2H5*    G  10          2H5*        G  10   7.917  -3.941  21.492
  103    H4*    G  10           H4*        G  10   6.993  -5.016  23.329
  104    H3*    G  10           H3*        G  10   4.708  -4.607  21.371
  105    H2*    G  10           H2*        G  10   3.337  -5.867  22.793
  106   2HO*    G  10          2HO*        G  10   5.203  -7.314  23.347
  107    H1*    G  10           H1*        G  10   4.135  -4.591  25.065
  108    H8     G  10           H8         G  10   4.293  -1.578  23.089
  109    H1     G  10           H1         G  10  -1.796  -3.552  23.736
  110   1H2     G  10          2H2         G  10  -1.822  -5.753  24.137
  111   2H2     G  10          1H2         G  10  -0.326  -6.652  24.397
  112    H5T    G  10           H5T        G  10   6.162  -3.530  20.227
  113   1H5*    U  11          1H5*        U  11   4.651  -8.613  20.955
  114   2H5*    U  11          2H5*        U  11   4.515  -9.070  19.249
  115    H4*    U  11           H4*        U  11   2.485  -9.627  20.520
  116    H3*    U  11           H3*        U  11   2.147  -7.423  18.472
  117    H2*    U  11           H2*        U  11  -0.211  -7.537  18.978
  118   2HO*    U  11          2HO*        U  11  -0.072  -9.925  19.238
  119    H1*    U  11           H1*        U  11   0.102  -7.622  21.664
  120    H3     U  11           H3         U  11  -1.631  -3.562  20.434
  121    H5     U  11           H5         U  11   2.540  -3.108  20.163
  122    H6     U  11           H6         U  11   2.776  -5.487  20.528
  123   1H5*    C  12          1H5*        C  12  -0.984 -10.375  17.653
  124   2H5*    C  12          2H5*        C  12  -1.268 -10.446  15.907
  125    H4*    C  12           H4*        C  12  -3.281  -9.820  17.306
  126    H3*    C  12           H3*        C  12  -2.309  -7.914  15.166
  127    H2*    C  12           H2*        C  12  -4.249  -6.575  15.659
  128   2HO*    C  12          2HO*        C  12  -5.490  -8.671  16.016
  129    H1*    C  12           H1*        C  12  -4.077  -6.845  18.393
  130   1H4     C  12          2H4         C  12  -1.635  -1.222  17.208
  131   2H4     C  12          1H4         C  12   0.015  -1.851  17.124
  132    H5     C  12           H5         C  12   0.423  -4.328  17.080
  133    H6     C  12           H6         C  12  -0.658  -6.481  17.270
  134   1H5*    G  13          1H5*        G  13  -6.364  -7.587  14.387
  135   2H5*    G  13          2H5*        G  13  -6.590  -7.743  12.639
  136    H4*    G  13           H4*        G  13  -7.352  -5.556  13.401
  137    H3*    G  13           H3*        G  13  -4.851  -5.518  11.705
  138    H2*    G  13           H2*        G  13  -5.003  -3.138  11.682
  139   2HO*    G  13          2HO*        G  13  -7.335  -3.077  11.450
  140    H1*    G  13           H1*        G  13  -5.570  -2.898  14.363
  141    H8     G  13           H8         G  13  -3.117  -5.749  13.595
  142    H1     G  13           H1         G  13  -0.322   0.012  14.054
  143   1H2     G  13          1H2         G  13  -1.849   1.588  14.320
  144   2H2     G  13          2H2         G  13  -3.558   1.246  14.294
  145   1H5*    A  14          1H5*        A  14  -7.478  -2.947   7.547
  146   2H5*    A  14          2H5*        A  14  -6.322  -2.091   8.597
  147    H4*    A  14           H4*        A  14  -9.363  -1.882   8.812
  148    H3*    A  14           H3*        A  14  -7.310  -0.206   7.364
  149    H2*    A  14           H2*        A  14  -8.446   1.782   8.012
  150   2HO*    A  14          2HO*        A  14 -10.560   0.725   7.592
  151    H1*    A  14           H1*        A  14  -9.043   0.986  10.584
  152    H8     A  14           H8         A  14  -5.592  -0.274  10.370
  153   1H6     A  14          1H6         A  14  -3.842   5.658  11.235
  154   2H6     A  14          2H6         A  14  -3.242   3.999  11.194
  155    H2     A  14           H2         A  14  -8.057   5.641   9.996
  156   1H5*    A  15          1H5*        A  15  -8.191   2.331   3.722
  157   2H5*    A  15          2H5*        A  15  -7.126   2.116   5.117
  158    H4*    A  15           H4*        A  15  -9.416   4.135   4.980
  159    H3*    A  15           H3*        A  15  -6.490   4.261   4.281
  160    H2*    A  15           H2*        A  15  -6.238   6.401   5.299
  161   2HO*    A  15          2HO*        A  15  -8.550   6.901   4.539
  162    H1*    A  15           H1*        A  15  -7.533   5.800   7.596
  163    H8     A  15           H8         A  15  -6.236   2.450   7.090
  164   1H6     A  15          1H6         A  15  -0.529   4.547   8.358
  165   2H6     A  15          2H6         A  15  -1.508   3.095   8.110
  166    H2     A  15           H2         A  15  -3.171   8.040   7.889
  167   1H5*    G  16          1H5*        G  16  -6.864   7.999   3.358
  168   2H5*    G  16          2H5*        G  16  -6.384   8.281   1.674
  169    H4*    G  16           H4*        G  16  -4.972   9.560   3.222
  170    H3*    G  16           H3*        G  16  -3.621   7.312   1.714
  171    H2*    G  16           H2*        G  16  -1.534   8.056   2.664
  172   2HO*    G  16          2HO*        G  16  -2.343  10.359   2.479
  173    H1*    G  16           H1*        G  16  -2.499   8.373   5.196
  174    H8     G  16           H8         G  16  -4.351   5.335   4.050
  175    H1     G  16           H1         G  16   1.831   4.160   5.389
  176   1H2     G  16          1H2         G  16   2.961   5.868   5.268
  177   2H2     G  16          2H2         G  16   2.420   7.460   5.009
  178   1H5*    C  17          1H5*        C  17  -1.082  10.754   1.055
  179   2H5*    C  17          2H5*        C  17  -0.633  10.790  -0.660
  180    H4*    C  17           H4*        C  17   1.350  10.741   0.850
  181    H3*    C  17           H3*        C  17   0.904   8.329  -0.922
  182    H2*    C  17           H2*        C  17   3.064   7.577  -0.231
  183   2HO*    C  17          2HO*        C  17   4.488   8.814   0.913
  184    H1*    C  17           H1*        C  17   2.660   8.265   2.427
  185   1H4     C  17          2H4         C  17   1.584   2.088   2.291
  186   2H4     C  17          1H4         C  17  -0.131   2.333   1.969
  187    H5     C  17           H5         C  17  -1.020   4.570   1.334
  188    H6     C  17           H6         C  17  -0.448   6.912   1.118
  189   1H5*    C  18          1H5*        C  18   4.944   9.819  -1.601
  190   2H5*    C  18          2H5*        C  18   5.261   9.816  -3.344
  191    H4*    C  18           H4*        C  18   7.032   8.596  -2.168
  192    H3*    C  18           H3*        C  18   5.161   6.811  -3.780
  193    H2*    C  18           H2*        C  18   6.700   5.044  -3.355
  194   2HO*    C  18          2HO*        C  18   8.539   6.628  -3.601
  195    H1*    C  18           H1*        C  18   7.105   5.771  -0.701
  196   1H4     C  18          2H4         C  18   2.866   1.112  -0.431
  197   2H4     C  18          1H4         C  18   1.523   2.192  -0.802
  198    H5     C  18           H5         C  18   1.919   4.544  -1.511
  199    H6     C  18           H6         C  18   3.623   6.228  -1.829
  200    H3T    C  18           H3T        C  18   6.297   8.342  -5.009
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1   5.063  -9.016   0.684
    2   2H5*    G   1          2H5*        G   1   5.741  -8.887   2.315
    3    H4*    G   1           H4*        G   1   7.309  -7.895   0.798
    4    H3*    G   1           H3*        G   1   5.759  -5.768   2.305
    5    H2*    G   1           H2*        G   1   7.278  -4.175   1.362
    6   2HO*    G   1          2HO*        G   1   9.100  -5.750   1.513
    7    H1*    G   1           H1*        G   1   7.058  -5.179  -1.165
    8    H8     G   1           H8         G   1   3.609  -5.772   0.112
    9    H1     G   1           H1         G   1   4.777   0.479  -0.886
   10   1H2     G   1          2H2         G   1   6.986   0.800  -1.092
   11   2H2     G   1          1H2         G   1   8.109  -0.560  -1.050
   12    H5T    G   1           H5T        G   1   4.345  -7.197   2.748
   13   1H5*    G   2          1H5*        G   2   9.745  -4.803   3.201
   14   2H5*    G   2          2H5*        G   2   9.876  -4.325   4.903
   15    H4*    G   2           H4*        G   2  10.640  -2.566   3.316
   16    H3*    G   2           H3*        G   2   8.233  -1.924   5.035
   17    H2*    G   2           H2*        G   2   8.391   0.323   4.158
   18   2HO*    G   2          2HO*        G   2  10.819   0.127   4.144
   19    H1*    G   2           H1*        G   2   8.728  -0.456   1.573
   20    H8     G   2           H8         G   2   6.244  -2.926   2.987
   21    H1     G   2           H1         G   2   3.800   2.971   2.175
   22   1H2     G   2          2H2         G   2   5.504   4.443   1.944
   23   2H2     G   2          1H2         G   2   7.168   3.866   1.826
   24   1H5*    C   3          1H5*        C   3  10.976   1.408   5.533
   25   2H5*    C   3          2H5*        C   3  11.000   1.885   7.238
   26    H4*    C   3           H4*        C   3  10.407   3.747   5.672
   27    H3*    C   3           H3*        C   3   8.327   2.902   7.710
   28    H2*    C   3           H2*        C   3   7.094   4.846   6.993
   29   2HO*    C   3          2HO*        C   3   9.201   6.042   6.729
   30    H1*    C   3           H1*        C   3   7.534   4.439   4.320
   31   1H4     C   3          2H4         C   3   1.783   1.932   5.455
   32   2H4     C   3          1H4         C   3   2.554   0.381   5.682
   33    H5     C   3           H5         C   3   4.948   0.056   5.881
   34    H6     C   3           H6         C   3   7.096   1.136   5.714
   35   1H5*    U   4          1H5*        U   4   7.950   6.872   8.350
   36   2H5*    U   4          2H5*        U   4   7.908   7.190  10.094
   37    H4*    U   4           H4*        U   4   5.781   7.826   9.022
   38    H3*    U   4           H3*        U   4   5.557   5.332  10.716
   39    H2*    U   4           H2*        U   4   3.182   5.608  10.569
   40   2HO*    U   4          2HO*        U   4   3.104   7.964  10.455
   41    H1*    U   4           H1*        U   4   3.352   5.902   7.863
   42    H3     U   4           H3         U   4   1.701   1.724   8.908
   43    H5     U   4           H5         U   4   5.875   1.309   9.051
   44    H6     U   4           H6         U   4   6.089   3.694   8.769
   45   1H5*    A   5          1H5*        A   5   3.023   8.265  14.167
   46   2H5*    A   5          2H5*        A   5   3.422   6.754  13.327
   47    H4*    A   5           H4*        A   5   0.863   8.361  12.893
   48    H3*    A   5           H3*        A   5   1.489   5.881  14.527
   49    H2*    A   5           H2*        A   5  -0.737   5.123  14.090
   50   2HO*    A   5          2HO*        A   5  -1.708   7.287  14.237
   51    H1*    A   5           H1*        A   5  -0.613   5.674  11.411
   52    H8     A   5           H8         A   5   2.849   4.654  12.631
   53   1H6     A   5          1H6         A   5   1.009  -1.180  11.546
   54   2H6     A   5          2H6         A   5   2.421  -0.170  11.834
   55    H2     A   5           H2         A   5  -2.535   1.383  11.325
   56   1H5*    A   6          1H5*        A   6  -2.749   7.622  17.982
   57   2H5*    A   6          2H5*        A   6  -3.018   6.171  16.994
   58    H4*    A   6           H4*        A   6  -4.023   9.003  16.427
   59    H3*    A   6           H3*        A   6  -5.298   6.448  17.390
   60    H2*    A   6           H2*        A   6  -7.232   6.777  16.061
   61   2HO*    A   6          2HO*        A   6  -6.979   9.202  16.434
   62    H1*    A   6           H1*        A   6  -5.914   7.292  13.770
   63    H8     A   6           H8         A   6  -3.223   5.195  14.986
   64   1H6     A   6          1H6         A   6  -6.760   0.272  13.746
   65   2H6     A   6          2H6         A   6  -5.130   0.793  14.162
   66    H2     A   6           H2         A   6  -9.403   3.802  13.854
   67   1H5*    G   7          1H5*        G   7  -8.302   7.392  18.427
   68   2H5*    G   7          2H5*        G   7  -8.732   6.950  20.091
   69    H4*    G   7           H4*        G   7  -9.702   5.438  18.350
   70    H3*    G   7           H3*        G   7  -7.703   4.162  20.241
   71    H2*    G   7           H2*        G   7  -8.388   2.062  19.222
   72   2HO*    G   7          2HO*        G   7 -10.658   2.930  18.997
   73    H1*    G   7           H1*        G   7  -8.235   3.025  16.673
   74    H8     G   7           H8         G   7  -5.348   4.643  18.508
   75    H1     G   7           H1         G   7  -4.419  -1.614  17.316
   76   1H2     G   7          2H2         G   7  -6.350  -2.556  16.724
   77   2H2     G   7          1H2         G   7  -7.809  -1.581  16.524
   78   1H5*    A   8          1H5*        A   8 -11.276   1.759  20.254
   79   2H5*    A   8          2H5*        A   8 -11.605   1.123  21.870
   80    H4*    A   8           H4*        A   8 -11.369  -0.622  20.060
   81    H3*    A   8           H3*        A   8  -9.504  -0.682  22.441
   82    H2*    A   8           H2*        A   8  -8.703  -2.803  21.578
   83   2HO*    A   8          2HO*        A   8 -10.996  -3.273  20.833
   84    H1*    A   8           H1*        A   8  -8.509  -1.948  18.986
   85    H8     A   8           H8         A   8  -7.355   1.055  20.927
   86   1H6     A   8          1H6         A   8  -1.812  -1.806  20.902
   87   2H6     A   8          2H6         A   8  -2.628  -0.263  21.124
   88    H2     A   8           H2         A   8  -4.900  -4.801  19.894
   89   1H5*    C   9          1H5*        C   9 -11.230  -4.629  22.251
   90   2H5*    C   9          2H5*        C   9 -11.650  -5.176  23.887
   91    H4*    C   9           H4*        C   9 -10.040  -6.715  22.784
   92    H3*    C   9           H3*        C   9  -8.970  -5.146  25.159
   93    H2*    C   9           H2*        C   9  -6.979  -6.434  24.999
   94   2HO*    C   9          2HO*        C   9  -6.850  -8.228  23.559
   95    H1*    C   9           H1*        C   9  -6.888  -6.342  22.215
   96   1H4     C   9          2H4         C   9  -2.836  -1.892  24.004
   97   2H4     C   9          1H4         C   9  -4.113  -0.696  24.236
   98    H5     C   9           H5         C   9  -6.509  -1.330  24.104
   99    H6     C   9           H6         C   9  -8.020  -3.144  23.624
  100    H3T    C   9           H3T        C   9  -9.493  -7.895  25.001
  101   1H5*    G  10          1H5*        G  10   6.857  -5.664  22.914
  102   2H5*    G  10          2H5*        G  10   7.040  -6.870  21.632
  103    H4*    G  10           H4*        G  10   5.770  -8.010  23.201
  104    H3*    G  10           H3*        G  10   3.779  -6.743  21.289
  105    H2*    G  10           H2*        G  10   2.065  -7.885  22.401
  106   2HO*    G  10          2HO*        G  10   3.526  -9.796  22.733
  107    H1*    G  10           H1*        G  10   2.953  -7.248  24.897
  108    H8     G  10           H8         G  10   3.932  -4.051  23.575
  109    H1     G  10           H1         G  10  -2.474  -4.639  23.524
  110   1H2     G  10          2H2         G  10  -3.017  -6.808  23.454
  111   2H2     G  10          1H2         G  10  -1.783  -8.062  23.602
  112    H5T    G  10           H5T        G  10   5.512  -5.851  20.413
  113   1H5*    U  11          1H5*        U  11   2.803 -10.454  20.181
  114   2H5*    U  11          2H5*        U  11   2.744 -10.597  18.416
  115    H4*    U  11           H4*        U  11   0.521 -10.859  19.414
  116    H3*    U  11           H3*        U  11   0.898  -8.317  17.815
  117    H2*    U  11           H2*        U  11  -1.466  -7.953  18.131
  118   2HO*    U  11          2HO*        U  11  -1.909 -10.297  17.917
  119    H1*    U  11           H1*        U  11  -1.478  -8.588  20.761
  120    H3     U  11           H3         U  11  -2.141  -4.083  20.286
  121    H5     U  11           H5         U  11   2.034  -4.576  20.348
  122    H6     U  11           H6         U  11   1.708  -6.970  20.247
  123   1H5*    C  12          1H5*        C  12  -2.686 -10.345  16.214
  124   2H5*    C  12          2H5*        C  12  -2.760 -10.050  14.469
  125    H4*    C  12           H4*        C  12  -4.781  -9.274  15.757
  126    H3*    C  12           H3*        C  12  -3.179  -7.237  14.193
  127    H2*    C  12           H2*        C  12  -4.900  -5.652  14.757
  128   2HO*    C  12          2HO*        C  12  -6.537  -7.466  14.511
  129    H1*    C  12           H1*        C  12  -5.175  -6.482  17.371
  130   1H4     C  12          2H4         C  12  -1.596  -1.347  17.686
  131   2H4     C  12          1H4         C  12  -0.101  -2.276  17.549
  132    H5     C  12           H5         C  12  -0.156  -4.708  16.978
  133    H6     C  12           H6         C  12  -1.626  -6.590  16.609
  134   1H5*    G  13          1H5*        G  13  -7.024  -6.085  13.002
  135   2H5*    G  13          2H5*        G  13  -6.986  -5.806  11.255
  136    H4*    G  13           H4*        G  13  -7.594  -3.768  12.453
  137    H3*    G  13           H3*        G  13  -4.875  -3.668  11.126
  138    H2*    G  13           H2*        G  13  -4.868  -1.313  11.669
  139   2HO*    G  13          2HO*        G  13  -7.196  -1.061  11.269
  140    H1*    G  13           H1*        G  13  -5.644  -1.704  14.258
  141    H8     G  13           H8         G  13  -3.506  -4.653  13.087
  142    H1     G  13           H1         G  13  -0.038   0.373  15.061
  143   1H2     G  13          1H2         G  13  -1.349   2.139  15.386
  144   2H2     G  13          2H2         G  13  -3.058   2.089  15.035
  145   1H5*    A  14          1H5*        A  14  -8.879  -1.626   9.507
  146   2H5*    A  14          2H5*        A  14  -8.589  -1.113   7.834
  147    H4*    A  14           H4*        A  14 -10.072   0.429   9.109
  148    H3*    A  14           H3*        A  14  -7.410   1.598   8.322
  149    H2*    A  14           H2*        A  14  -8.415   3.747   8.889
  150   2HO*    A  14          2HO*        A  14 -10.754   2.818   8.481
  151    H1*    A  14           H1*        A  14  -9.062   2.769  11.335
  152    H8     A  14           H8         A  14  -6.002   0.770  10.745
  153   1H6     A  14          1H6         A  14  -2.822   6.003  11.922
  154   2H6     A  14          2H6         A  14  -2.667   4.253  11.745
  155    H2     A  14           H2         A  14  -6.989   7.099  11.014
  156   1H5*    A  15          1H5*        A  15  -8.712   4.442   4.641
  157   2H5*    A  15          2H5*        A  15  -7.639   3.791   5.894
  158    H4*    A  15           H4*        A  15  -9.083   6.475   6.084
  159    H3*    A  15           H3*        A  15  -6.355   5.688   5.067
  160    H2*    A  15           H2*        A  15  -5.367   7.610   6.102
  161   2HO*    A  15          2HO*        A  15  -7.477   8.816   5.589
  162    H1*    A  15           H1*        A  15  -6.591   7.315   8.502
  163    H8     A  15           H8         A  15  -6.344   3.761   7.772
  164   1H6     A  15          1H6         A  15  -0.204   4.107   8.683
  165   2H6     A  15          2H6         A  15  -1.562   2.998   8.446
  166    H2     A  15           H2         A  15  -1.783   8.213   8.573
  167   1H5*    G  16          1H5*        G  16  -5.858   9.570   4.300
  168   2H5*    G  16          2H5*        G  16  -5.410   9.806   2.601
  169    H4*    G  16           H4*        G  16  -3.682  10.677   4.123
  170    H3*    G  16           H3*        G  16  -2.928   8.279   2.439
  171    H2*    G  16           H2*        G  16  -0.678   8.534   3.278
  172   2HO*    G  16          2HO*        G  16  -1.001  10.958   3.250
  173    H1*    G  16           H1*        G  16  -1.423   8.886   5.879
  174    H8     G  16           H8         G  16  -3.924   6.361   4.709
  175    H1     G  16           H1         G  16   1.959   3.881   5.503
  176   1H2     G  16          1H2         G  16   3.406   5.342   5.407
  177   2H2     G  16          2H2         G  16   3.178   7.024   5.298
  178   1H5*    C  17          1H5*        C  17   0.193  11.203   1.776
  179   2H5*    C  17          2H5*        C  17   0.546  11.271   0.040
  180    H4*    C  17           H4*        C  17   2.563  10.791   1.413
  181    H3*    C  17           H3*        C  17   1.620   8.625  -0.485
  182    H2*    C  17           H2*        C  17   3.664   7.462   0.050
  183   2HO*    C  17          2HO*        C  17   4.786   9.642   0.161
  184    H1*    C  17           H1*        C  17   3.518   7.990   2.750
  185   1H4     C  17          2H4         C  17   1.205   2.168   2.288
  186   2H4     C  17          1H4         C  17  -0.444   2.772   2.137
  187    H5     C  17           H5         C  17  -0.899   5.187   1.724
  188    H6     C  17           H6         C  17   0.123   7.374   1.608
  189   1H5*    C  18          1H5*        C  18   5.896   9.292  -1.388
  190   2H5*    C  18          2H5*        C  18   6.017   9.387  -3.154
  191    H4*    C  18           H4*        C  18   7.563   7.693  -2.301
  192    H3*    C  18           H3*        C  18   5.161   6.527  -3.771
  193    H2*    C  18           H2*        C  18   6.295   4.434  -3.665
  194   2HO*    C  18          2HO*        C  18   8.407   5.594  -4.049
  195    H1*    C  18           H1*        C  18   7.155   4.818  -1.042
  196   1H4     C  18          2H4         C  18   2.057   1.133  -0.593
  197   2H4     C  18          1H4         C  18   0.946   2.498  -0.702
  198    H5     C  18           H5         C  18   1.768   4.782  -1.265
  199    H6     C  18           H6         C  18   3.756   6.102  -1.657
  200    H3T    C  18           H3T        C  18   6.466   7.877  -5.041
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1   4.782  -7.846   0.976
    2   2H5*    G   1          2H5*        G   1   5.948  -7.943   2.303
    3    H4*    G   1           H4*        G   1   7.218  -7.086   0.551
    4    H3*    G   1           H3*        G   1   6.224  -4.693   2.138
    5    H2*    G   1           H2*        G   1   7.618  -3.336   0.814
    6   2HO*    G   1          2HO*        G   1   9.292  -5.074   0.690
    7    H1*    G   1           H1*        G   1   6.751  -4.416  -1.523
    8    H8     G   1           H8         G   1   3.559  -4.861   0.155
    9    H1     G   1           H1         G   1   4.798   1.387  -0.732
   10   1H2     G   1          2H2         G   1   7.004   1.683  -0.971
   11   2H2     G   1          1H2         G   1   8.103   0.304  -1.054
   12    H5T    G   1           H5T        G   1   5.091  -6.125   3.224
   13   1H5*    G   2          1H5*        G   2  10.061  -4.134   3.147
   14   2H5*    G   2          2H5*        G   2  10.209  -3.756   4.870
   15    H4*    G   2           H4*        G   2  10.845  -1.873   3.394
   16    H3*    G   2           H3*        G   2   8.391  -1.437   5.112
   17    H2*    G   2           H2*        G   2   8.459   0.848   4.341
   18   2HO*    G   2          2HO*        G   2  10.892   0.772   4.378
   19    H1*    G   2           H1*        G   2   8.913   0.215   1.728
   20    H8     G   2           H8         G   2   6.465  -2.389   2.851
   21    H1     G   2           H1         G   2   3.888   3.506   2.519
   22   1H2     G   2          2H2         G   2   5.564   5.028   2.391
   23   2H2     G   2          1H2         G   2   7.238   4.489   2.248
   24   1H5*    C   3          1H5*        C   3  11.060   1.937   5.807
   25   2H5*    C   3          2H5*        C   3  11.056   2.339   7.531
   26    H4*    C   3           H4*        C   3  10.450   4.255   6.022
   27    H3*    C   3           H3*        C   3   8.406   3.305   8.048
   28    H2*    C   3           H2*        C   3   7.119   5.238   7.410
   29   2HO*    C   3          2HO*        C   3   9.214   6.480   7.167
   30    H1*    C   3           H1*        C   3   7.550   4.956   4.721
   31   1H4     C   3          2H4         C   3   1.853   2.295   5.719
   32   2H4     C   3          1H4         C   3   2.647   0.749   5.886
   33    H5     C   3           H5         C   3   5.051   0.455   6.039
   34    H6     C   3           H6         C   3   7.179   1.579   5.925
   35   1H5*    U   4          1H5*        U   4   8.049   7.279   8.822
   36   2H5*    U   4          2H5*        U   4   8.015   7.543  10.575
   37    H4*    U   4           H4*        U   4   5.899   8.237   9.519
   38    H3*    U   4           H3*        U   4   5.702   5.801  11.309
   39    H2*    U   4           H2*        U   4   3.305   5.984  11.026
   40   2HO*    U   4          2HO*        U   4   3.288   8.327  11.049
   41    H1*    U   4           H1*        U   4   3.442   6.387   8.327
   42    H3     U   4           H3         U   4   1.762   2.172   9.083
   43    H5     U   4           H5         U   4   5.927   1.722   9.312
   44    H6     U   4           H6         U   4   6.161   4.117   9.181
   45   1H5*    A   5          1H5*        A   5   2.798   8.886  12.628
   46   2H5*    A   5          2H5*        A   5   2.605   8.790  14.385
   47    H4*    A   5           H4*        A   5   0.456   8.506  13.112
   48    H3*    A   5           H3*        A   5   1.398   6.046  14.606
   49    H2*    A   5           H2*        A   5  -0.813   5.192  14.283
   50   2HO*    A   5          2HO*        A   5  -1.837   7.447  14.340
   51    H1*    A   5           H1*        A   5  -0.686   5.817  11.609
   52    H8     A   5           H8         A   5   2.802   4.886  12.907
   53   1H6     A   5          1H6         A   5   1.172  -0.975  11.661
   54   2H6     A   5          2H6         A   5   2.537   0.074  12.028
   55    H2     A   5           H2         A   5  -2.425   1.507  11.266
   56   1H5*    A   6          1H5*        A   6  -2.567   8.210  17.665
   57   2H5*    A   6          2H5*        A   6  -2.351   6.759  16.656
   58    H4*    A   6           H4*        A   6  -4.413   8.966  16.178
   59    H3*    A   6           H3*        A   6  -4.664   6.208  17.422
   60    H2*    A   6           H2*        A   6  -6.930   6.199  16.568
   61   2HO*    A   6          2HO*        A   6  -7.055   8.607  16.971
   62    H1*    A   6           H1*        A   6  -6.187   7.003  14.078
   63    H8     A   6           H8         A   6  -3.258   4.933  15.125
   64   1H6     A   6          1H6         A   6  -6.716   0.015  13.564
   65   2H6     A   6          2H6         A   6  -5.089   0.509  14.017
   66    H2     A   6           H2         A   6  -9.394   3.484  13.843
   67   1H5*    G   7          1H5*        G   7  -8.127   6.910  18.567
   68   2H5*    G   7          2H5*        G   7  -8.409   6.428  20.251
   69    H4*    G   7           H4*        G   7  -9.658   5.037  18.600
   70    H3*    G   7           H3*        G   7  -7.551   3.600  20.236
   71    H2*    G   7           H2*        G   7  -8.402   1.559  19.224
   72   2HO*    G   7          2HO*        G   7 -10.648   2.535  19.222
   73    H1*    G   7           H1*        G   7  -8.413   2.560  16.697
   74    H8     G   7           H8         G   7  -5.380   4.154  18.296
   75    H1     G   7           H1         G   7  -4.588  -2.111  17.048
   76   1H2     G   7          2H2         G   7  -6.551  -3.020  16.512
   77   2H2     G   7          1H2         G   7  -8.008  -2.028  16.398
   78   1H5*    A   8          1H5*        A   8 -11.181   1.313  20.481
   79   2H5*    A   8          2H5*        A   8 -11.398   0.632  22.098
   80    H4*    A   8           H4*        A   8 -11.354  -1.053  20.211
   81    H3*    A   8           H3*        A   8  -9.344  -1.251  22.460
   82    H2*    A   8           H2*        A   8  -8.655  -3.358  21.478
   83   2HO*    A   8          2HO*        A   8 -11.006  -3.739  20.863
   84    H1*    A   8           H1*        A   8  -8.596  -2.424  18.909
   85    H8     A   8           H8         A   8  -7.252   0.502  20.833
   86   1H6     A   8          1H6         A   8  -1.797  -2.496  20.476
   87   2H6     A   8          2H6         A   8  -2.563  -0.939  20.767
   88    H2     A   8           H2         A   8  -5.010  -5.395  19.573
   89   1H5*    C   9          1H5*        C   9 -11.176  -5.138  22.260
   90   2H5*    C   9          2H5*        C   9 -11.519  -5.725  23.900
   91    H4*    C   9           H4*        C   9 -10.007  -7.265  22.669
   92    H3*    C   9           H3*        C   9  -8.774  -5.788  25.023
   93    H2*    C   9           H2*        C   9  -6.823  -7.110  24.718
   94   2HO*    C   9          2HO*        C   9  -6.810  -8.863  23.224
   95    H1*    C   9           H1*        C   9  -6.879  -6.937  21.938
   96   1H4     C   9          2H4         C   9  -2.647  -2.623  23.640
   97   2H4     C   9          1H4         C   9  -3.885  -1.405  23.958
   98    H5     C   9           H5         C   9  -6.298  -1.985  23.925
   99    H6     C   9           H6         C   9  -7.870  -3.755  23.477
  100    H3T    C   9           H3T        C   9  -9.363  -8.521  24.818
  101   1H5*    G  10          1H5*        G  10   6.888  -6.568  22.020
  102   2H5*    G  10          2H5*        G  10   6.988  -7.728  20.688
  103    H4*    G  10           H4*        G  10   5.771  -8.904  22.273
  104    H3*    G  10           H3*        G  10   3.718  -7.533  20.503
  105    H2*    G  10           H2*        G  10   2.034  -8.682  21.654
  106   2HO*    G  10          2HO*        G  10   3.472 -10.629  21.853
  107    H1*    G  10           H1*        G  10   3.045  -8.144  24.125
  108    H8     G  10           H8         G  10   4.041  -4.928  22.857
  109    H1     G  10           H1         G  10  -2.372  -5.371  23.089
  110   1H2     G  10          2H2         G  10  -2.968  -7.525  22.976
  111   2H2     G  10          1H2         G  10  -1.759  -8.810  23.026
  112    H5T    G  10           H5T        G  10   5.427  -6.639  19.579
  113   1H5*    U  11          1H5*        U  11   2.614 -11.183  19.306
  114   2H5*    U  11          2H5*        U  11   2.486 -11.259  17.540
  115    H4*    U  11           H4*        U  11   0.297 -11.518  18.604
  116    H3*    U  11           H3*        U  11   0.665  -8.913  17.105
  117    H2*    U  11           H2*        U  11  -1.680  -8.524  17.521
  118   2HO*    U  11          2HO*        U  11  -2.171 -10.850  17.220
  119    H1*    U  11           H1*        U  11  -1.608  -9.275  20.121
  120    H3     U  11           H3         U  11  -2.206  -4.743  19.858
  121    H5     U  11           H5         U  11   1.959  -5.304  19.719
  122    H6     U  11           H6         U  11   1.587  -7.688  19.550
  123   1H5*    C  12          1H5*        C  12  -3.010 -10.800  15.534
  124   2H5*    C  12          2H5*        C  12  -3.122 -10.430  13.805
  125    H4*    C  12           H4*        C  12  -5.097  -9.671  15.162
  126    H3*    C  12           H3*        C  12  -3.477  -7.587  13.677
  127    H2*    C  12           H2*        C  12  -5.162  -6.003  14.346
  128   2HO*    C  12          2HO*        C  12  -6.835  -7.770  14.031
  129    H1*    C  12           H1*        C  12  -5.411  -6.963  16.919
  130   1H4     C  12          2H4         C  12  -1.743  -1.886  17.344
  131   2H4     C  12          1H4         C  12  -0.265  -2.830  17.137
  132    H5     C  12           H5         C  12  -0.370  -5.238  16.476
  133    H6     C  12           H6         C  12  -1.878  -7.085  16.075
  134   1H5*    G  13          1H5*        G  13  -7.287  -6.262  12.588
  135   2H5*    G  13          2H5*        G  13  -7.251  -5.914  10.853
  136    H4*    G  13           H4*        G  13  -7.780  -3.903  12.121
  137    H3*    G  13           H3*        G  13  -5.045  -3.852  10.823
  138    H2*    G  13           H2*        G  13  -4.951  -1.527  11.456
  139   2HO*    G  13          2HO*        G  13  -7.244  -1.139  11.035
  140    H1*    G  13           H1*        G  13  -5.775  -1.990  14.023
  141    H8     G  13           H8         G  13  -3.731  -4.963  12.757
  142    H1     G  13           H1         G  13  -0.095  -0.060  14.738
  143   1H2     G  13          1H2         G  13  -1.359   1.722  15.140
  144   2H2     G  13          2H2         G  13  -3.084   1.716  14.868
  145   1H5*    A  14          1H5*        A  14  -8.930  -1.607   9.231
  146   2H5*    A  14          2H5*        A  14  -8.601  -1.053   7.580
  147    H4*    A  14           H4*        A  14 -10.053   0.477   8.912
  148    H3*    A  14           H3*        A  14  -7.408   1.581   7.935
  149    H2*    A  14           H2*        A  14  -8.215   3.724   8.734
  150   2HO*    A  14          2HO*        A  14 -10.469   3.079   8.048
  151    H1*    A  14           H1*        A  14  -9.097   2.746  11.129
  152    H8     A  14           H8         A  14  -5.978   0.767  10.557
  153   1H6     A  14          1H6         A  14  -2.928   5.994  12.123
  154   2H6     A  14          2H6         A  14  -2.713   4.267  11.829
  155    H2     A  14           H2         A  14  -7.099   7.043  11.238
  156   1H5*    A  15          1H5*        A  15  -9.782   4.805   6.832
  157   2H5*    A  15          2H5*        A  15  -9.390   5.215   5.154
  158    H4*    A  15           H4*        A  15  -9.018   7.116   6.665
  159    H3*    A  15           H3*        A  15  -6.555   5.945   5.355
  160    H2*    A  15           H2*        A  15  -5.316   7.780   6.324
  161   2HO*    A  15          2HO*        A  15  -7.295   9.198   5.965
  162    H1*    A  15           H1*        A  15  -6.434   7.579   8.797
  163    H8     A  15           H8         A  15  -6.217   4.016   7.758
  164   1H6     A  15          1H6         A  15  -0.106   4.381   8.877
  165   2H6     A  15          2H6         A  15  -1.428   3.266   8.494
  166    H2     A  15           H2         A  15  -1.755   8.442   9.095
  167   1H5*    G  16          1H5*        G  16  -5.885  10.004   4.692
  168   2H5*    G  16          2H5*        G  16  -5.402  10.241   3.004
  169    H4*    G  16           H4*        G  16  -3.692  11.039   4.610
  170    H3*    G  16           H3*        G  16  -2.942   8.718   2.821
  171    H2*    G  16           H2*        G  16  -0.694   8.943   3.688
  172   2HO*    G  16          2HO*        G  16  -1.007  11.360   3.765
  173    H1*    G  16           H1*        G  16  -1.468   9.180   6.295
  174    H8     G  16           H8         G  16  -3.901   6.671   4.902
  175    H1     G  16           H1         G  16   1.991   4.255   5.822
  176   1H2     G  16          1H2         G  16   3.411   5.742   5.859
  177   2H2     G  16          2H2         G  16   3.157   7.423   5.802
  178   1H5*    C  17          1H5*        C  17   0.162  11.757   2.353
  179   2H5*    C  17          2H5*        C  17   0.561  11.896   0.632
  180    H4*    C  17           H4*        C  17   2.548  11.426   2.063
  181    H3*    C  17           H3*        C  17   1.745   9.338   0.021
  182    H2*    C  17           H2*        C  17   3.799   8.202   0.573
  183   2HO*    C  17          2HO*        C  17   4.867  10.387   0.817
  184    H1*    C  17           H1*        C  17   3.552   8.590   3.288
  185   1H4     C  17          2H4         C  17   1.404   2.728   2.530
  186   2H4     C  17          1H4         C  17  -0.247   3.309   2.350
  187    H5     C  17           H5         C  17  -0.747   5.717   2.001
  188    H6     C  17           H6         C  17   0.219   7.932   1.996
  189   1H5*    C  18          1H5*        C  18   6.019  10.243  -0.748
  190   2H5*    C  18          2H5*        C  18   6.203  10.357  -2.509
  191    H4*    C  18           H4*        C  18   7.749   8.681  -1.533
  192    H3*    C  18           H3*        C  18   5.537   7.607  -3.323
  193    H2*    C  18           H2*        C  18   6.550   5.469  -3.148
  194   2HO*    C  18          2HO*        C  18   8.629   5.205  -2.220
  195    H1*    C  18           H1*        C  18   7.226   5.745  -0.439
  196   1H4     C  18          2H4         C  18   2.127   2.052  -0.472
  197   2H4     C  18          1H4         C  18   1.031   3.426  -0.599
  198    H5     C  18           H5         C  18   1.882   5.722  -1.018
  199    H6     C  18           H6         C  18   3.887   7.052  -1.251
  200    H3T    C  18           H3T        C  18   8.283   7.698  -3.859


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